diff --git "a/data/104.csv" "b/data/104.csv" --- "a/data/104.csv" +++ "b/data/104.csv" @@ -1,65096 +1,64922 @@ product_name,product_smiles,heavy_atoms,r1_hashisy -"""C9860CC7A4EE9870_975D010306A010B9_6038_UN""","""CC(=O)[C@@H]1CC[C@H](CC1)NC(=O)CCC2=CC=C(C=C2)F""",21,"""088E70ED5FCA640B""" -"""4C8E74A46DFE2B78_1D449269292796A2_6038_UN""","""CC(=O)[C@@H]1CC[C@H](CC1)NC(C2=CSC(=C2)[S](N)(=O)=O)=O""",21,"""088E70ED5FCA640B""" -"""DA2B32C3AFCC3BC1_57F1B8F62DE389D3_6038_UN""","""CC(=O)[C@@H]1CC[C@H](CC1)NC(=O)CCC2=CC(=CC=C2)F""",21,"""088E70ED5FCA640B""" -"""66B22E380D39408B_E0794E28BAE5293B_6038_UN""","""CC(=O)[C@@H]1CC[C@H](CC1)NC(C2=C(C(=NNC2=O)C)C)=O""",21,"""088E70ED5FCA640B""" -"""57C7DAC0902C2FAB_1360E5B1F7EC1725_6038_UN""","""CC(=O)[C@@H]1CC[C@H](CC1)NC(CN2C(CN(C)C2=O)=O)=O""",21,"""088E70ED5FCA640B""" -"""CC91CC69CB0A2844_37D9E2B1868C5965_6038_UN""","""CC(=O)[C@@H]1CC[C@H](CC1)NC(=O)CSC2=CC=C(C=C2)F""",21,"""088E70ED5FCA640B""" 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-"""7E9BD988B686A33B_8DE86BA20E9456F6_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2([S](N)(=O)=O)CC2)=O""",21,"""6AF0164D80B346A7""" -"""ACCE9C4E4D0676EC_9CAE982FFF218896_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C3(C)CC2CC2C3)=O""",21,"""6AF0164D80B346A7""" -"""7B68A70FD1D10931_0EFA8D6D9B289596_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CCCC2CCC2""",21,"""6AF0164D80B346A7""" -"""BC2A2D6553192770_EB59D0C44D5A5245_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C=C[P](CC)(=O)O)=O""",21,"""6AF0164D80B346A7""" -"""3718BA57A4741936_EE4A2F22D4A1566B_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2C(CCN2)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""0BEBD575E3723B3E_16D1CED1ACA72E9A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2=CN=C(C)S2)=O""",21,"""6AF0164D80B346A7""" -"""02C4ED95874A240E_F1DE21B94A39CA3A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(C)C=N[N]2C)=O""",21,"""6AF0164D80B346A7""" -"""6458A4B94B880A05_66A829B6D98C27FF_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[N]2N=C(N)C=C2)=O""",21,"""6AF0164D80B346A7""" -"""CFE4CC24CD3C12CE_8D3D8FBADFE7BEFB_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C=C2CCNCC2)=O""",21,"""6AF0164D80B346A7""" -"""647EE539ABA7CD8A_B4D1B819D1CD616A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(C)[NH]C(=N2)C)=O""",21,"""6AF0164D80B346A7""" -"""2373C2C760CF3EDC_4678D0A38EB77193_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CON=C2CC)=O""",21,"""6AF0164D80B346A7""" -"""FCF088F16BA19778_66F4169B688DF545_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=N[N](CC)C=C2)=O""",21,"""6AF0164D80B346A7""" -"""950CCE0E95E699C7_7F5769D3BD3C60BE_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=N[NH]C(=C2)OC)=O""",21,"""6AF0164D80B346A7""" -"""E1BE3C38646447BD_FE2C5F9DD618ACBB_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CSC(=C2)C#N""",21,"""6AF0164D80B346A7""" -"""9FD8F1D6B7E4D477_64AA38E5231C4B9A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CC=CC(=N2)C)=O""",21,"""6AF0164D80B346A7""" -"""4F4DCAEEAD3FBD3B_F0A76E0D179C0D1E_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(C)[N](N=C2)C)=O""",21,"""6AF0164D80B346A7""" -"""253D2F6494209A31_691109C0F835377F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(CCCC2C)C)=O""",21,"""6AF0164D80B346A7""" -"""AB6D01BB45B41142_EBEA7F274D24BE0A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(C)SC(=C2)C)=O""",21,"""6AF0164D80B346A7""" -"""1F9E9DC909C1388A_90B34953A1FE246D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(OC(C)C)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""8263362AF39C1FCB_20DAC814F0DA0415_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(OCC(C)C)C)=O""",21,"""6AF0164D80B346A7""" -"""C70E78FB2831CE29_6286176F3A7B4EEB_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CCC2=NC=CS2""",21,"""6AF0164D80B346A7""" -"""48BD755DDD03613F_70325B3A045C9412_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[S](CCC)(=O)=O)=O""",21,"""6AF0164D80B346A7""" -"""1E9DF5ADB4D6F292_5F605ACB589D819A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(SCCCC)C)=O""",21,"""6AF0164D80B346A7""" -"""3A26506730F97581_62315F9C775BFB36_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C)C2=CCCC2)=O""",21,"""6AF0164D80B346A7""" -"""D930193D23BCB20E_2C890C118FC02FD3_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(N(C)C)C2CC2)=O""",21,"""6AF0164D80B346A7""" -"""E0ED585127F18CE0_097E1008B6966D53_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(N(CC)C)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""48DF54D3B1C1500E_99A2A0C4ED6C0D66_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C)C2=CSC=C2)=O""",21,"""6AF0164D80B346A7""" -"""F706FCF60BE7B4DF_7F0C629DE1151EF4_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NC(=C(S2)C)C)=O""",21,"""6AF0164D80B346A7""" -"""5EB7D8A99F88AED7_581E102F3423DC78_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(CC)SC=C2)=O""",21,"""6AF0164D80B346A7""" -"""742F9F5E8A869E6A_2B3C2A293284535F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)COC2=NOC=C2""",21,"""6AF0164D80B346A7""" -"""480298B58804453A_8669E35E5025BAF2_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CN(N)C(C2)=O)=O""",21,"""6AF0164D80B346A7""" -"""752EB69F80F3C245_3720A485BC813D87_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(ON=C2C)C)=O""",21,"""6AF0164D80B346A7""" -"""562FD252A443D8DA_2A8789751A849FD8_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C(CC)=O)CC2)=O""",21,"""6AF0164D80B346A7""" -"""3CB2DF605A1AD4BA_75AAAE472CDF703E_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CCC2=C[NH]N=N2""",21,"""6AF0164D80B346A7""" -"""B3A1790E149DE082_B9F0AD777D5D73EB_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)[C@@H]2CCO[C@H]2C=C""",21,"""6AF0164D80B346A7""" -"""AEAFB28F2E20B214_6EFED9B486C6CE2F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2C[C@H]2CC(C)C)=O""",21,"""6AF0164D80B346A7""" -"""7A972CC9110D481B_ADD9C3EBB81537B3_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CN(C)C(=O)C=C)=O""",21,"""6AF0164D80B346A7""" -"""A06E29FE38723FDA_0F2976FF3DD2658E_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CN2CC(C)(C2)C)=O""",21,"""6AF0164D80B346A7""" -"""00DC12F0F91999E6_F5C31CDF2A9764F4_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(CN(C)C)CC2)=O""",21,"""6AF0164D80B346A7""" -"""3A49F67B178E8350_629F0142D85E8166_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CCC[Si](C)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""47EFCA949B35C3CB_41AEAA416EB81174_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CCC)(C)CC)=O""",21,"""6AF0164D80B346A7""" -"""A0E6C941D77D890E_F0006794C07ED6B9_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CCCCCC#N""",21,"""6AF0164D80B346A7""" -"""3E015C53E760DB47_40DFF84439360698_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2CCCN2N=O""",21,"""6AF0164D80B346A7""" -"""96028C7FF8C03E6F_68749FCD04D18272_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2C(CC)NCC2)=O""",21,"""6AF0164D80B346A7""" -"""67C51174EEBED07A_13CFA88C68454324_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CC(=CC=C2)F""",21,"""6AF0164D80B346A7""" -"""170819DAB1382D1A_4216A1C00A8F0CB6_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CCC(C)CC2)=O""",21,"""6AF0164D80B346A7""" -"""3E5737F699035134_57690A3CF56ECF34_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CN=C(O)C=C2)=O""",21,"""6AF0164D80B346A7""" -"""E9899402422C4BD8_55DA3A41D184DDD0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CCCOC)C)=O""",21,"""6AF0164D80B346A7""" -"""92101BFA9A6717E3_862012BB762A5507_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C=CC(CC)=CC)=O""",21,"""6AF0164D80B346A7""" -"""452EB1A19B771B77_07A39B755DC0A99E_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2=C(C)SC=C2)=O""",21,"""6AF0164D80B346A7""" -"""3D6D11BCC1102FD7_33F1D2D0D5B34112_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(=COCC)C#N)=O""",21,"""6AF0164D80B346A7""" -"""B5BCA97E1C3C2E07_95E052619424EBFB_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2CCCC=C2""",21,"""6AF0164D80B346A7""" -"""B51C6E274D3FA81B_94BBDBED2EDDFFE8_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CCN(C2C)C)=O""",21,"""6AF0164D80B346A7""" -"""C6F7DF97145E8D7A_3BFB5A18BB924AFC_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CCC)N(C)C)=O""",21,"""6AF0164D80B346A7""" -"""D2AE0C4740A204B2_B745C3F38E5DA99C_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[S](N(C)C)(=O)=O)=O""",21,"""6AF0164D80B346A7""" -"""D0F79D09906B4C58_22642B45623CB281_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C(CC)CC)C)=O""",21,"""6AF0164D80B346A7""" -"""81CDC551C116CCB4_F2F2DC75F8EC03D3_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(COCCCOC)=O""",21,"""6AF0164D80B346A7""" -"""CB51E701967E519C_D66E2C45B6D71611_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CC(=N[N]2C)N)=O""",21,"""6AF0164D80B346A7""" -"""25F3004A56F4DD7E_92B765117BF0C48B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CCN(C)C2=O)=O""",21,"""6AF0164D80B346A7""" -"""3400B82189ADCAC7_58610567B38CCA7B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H](C(C)C)N(C)C)=O""",21,"""6AF0164D80B346A7""" -"""00D5928E4ADFD535_FA4A16E8C48CCDEE_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[S](NCC)(=O)=O)=O""",21,"""6AF0164D80B346A7""" -"""892AFC8EDFD0642D_DDE27C552C4AF64A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC(CC(C)C)C)=O""",21,"""6AF0164D80B346A7""" -"""ECD16D5FAFB90F78_7C5B8BCDD381E508_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2ON=C(CC)C2)=O""",21,"""6AF0164D80B346A7""" -"""5C1E0DBEE69692A6_BE01414F307AF1B0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CSC(=C2C)C)=O""",21,"""6AF0164D80B346A7""" -"""3092E76180C3FF9B_F80CCEF21EC4ABEA_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CCC[S](C)(=O)=O)=O""",21,"""6AF0164D80B346A7""" -"""3A68D30E6C47CAF3_5509B09324E6BED2_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(SC)C=CS2)=O""",21,"""6AF0164D80B346A7""" -"""29C1DDDEBA408574_928DA844B76F1CB9_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(COCCC(C)C)=O""",21,"""6AF0164D80B346A7""" -"""D4AC0730AD1BC54C_85A1CF04B9B9A507_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NN=C(CC)S2)=O""",21,"""6AF0164D80B346A7""" -"""16987498FF2B5922_EAF1C7E17E4BF0A4_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2=NC(=CS2)C)=O""",21,"""6AF0164D80B346A7""" -"""B361FCABCAEE2D55_6DC240F01CC6AC44_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C)CCC=CC2)=O""",21,"""6AF0164D80B346A7""" 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-"""C80B393D2F59BE51_AD545D2E2B983BEA_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=C[S](=O)CCC2""",21,"""6AF0164D80B346A7""" -"""2A5F89E72BFC2F21_606ACC988D120FED_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C)CCN(C)C)=O""",21,"""6AF0164D80B346A7""" -"""CB7F0E36EF3DF595_49F5A869D090DA0C_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=C(SC=C2)C#N""",21,"""6AF0164D80B346A7""" -"""E2E31DD750089C9B_3CA5EBB7CAA3C98F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)[CH]2CC[C](=[CH2])CC2""",21,"""6AF0164D80B346A7""" -"""9E6460D42D7B0B70_E28924B0ABE9E246_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2(CC=C)COC2""",21,"""6AF0164D80B346A7""" -"""E704D8048C3BE86D_C36392B8A50D33DA_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C[N](C=C2C)C)=O""",21,"""6AF0164D80B346A7""" -"""5D6D9F6A7E461EEF_A29D64BDEB08CCB3_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2CCO[C@H]2CC)=O""",21,"""6AF0164D80B346A7""" 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-"""7C7F14FF2B0DF862_07F757856581B05B_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@]23C[C@H]2CCCN3)=O""",21,"""6AF0164D80B346A7""" -"""24252C4A21DEFB50_0DCF32186E5A8CEF_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2(CNC2)C=C)=O""",21,"""6AF0164D80B346A7""" -"""67334136B9461D68_ECACDF4D46B7E9AA_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2CCC(=O)C2""",21,"""6AF0164D80B346A7""" -"""4F6E2568730C7A35_5068F15DDA6B5219_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2C[C@@H](OC)CN2)=O""",21,"""6AF0164D80B346A7""" -"""39162A00C77B2B72_082B156C58EC47F7_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2CCC=CC2""",21,"""6AF0164D80B346A7""" -"""7D49F0FF8476B31C_89C473DBA0DE77A1_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@]2(C[C@@H](CN2)F)C)=O""",21,"""6AF0164D80B346A7""" -"""1E2C4F22B7722AF6_6B87028DF3E077F6_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]2C[C@@H](C)NCC2)=O""",21,"""6AF0164D80B346A7""" 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-"""6BF518C3864CF388_97C938A151FA8430_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(O)C=CC=C2)=O""",21,"""6AF0164D80B346A7""" -"""4E5AAFF4A0DBFECB_4B87D1C6354F2198_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C3CCC2CC2N3)=O""",21,"""6AF0164D80B346A7""" -"""A47BBA7E9E7A4665_76AAD9FB160E69CE_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CCCCN=C=S""",21,"""6AF0164D80B346A7""" -"""BB166380F6AF8638_B2BBE924AC86EB22_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C(O)=O)COC2)=O""",21,"""6AF0164D80B346A7""" -"""6797A8B9F01ACBB3_F5C7491E5E02E370_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CCCOCC2""",21,"""6AF0164D80B346A7""" -"""1B574E2E2F369B9C_7A743A0642125A93_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2(CC(=O)C2)C#N""",21,"""6AF0164D80B346A7""" -"""651F2C5D32AEEA07_89BEFABA7E96B55B_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C23CCC2CCN3)=O""",21,"""6AF0164D80B346A7""" -"""D32ECFBF36C439EC_B26ECBC5FAE18C0D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C)CCC(=O)C2)=O""",21,"""6AF0164D80B346A7""" -"""D7C93FDDBE5D3F2A_E326A01C8826D70C_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CC(C(C)C)C2)=O""",21,"""6AF0164D80B346A7""" -"""C88C45B2C2060630_F44B72DEC997D8DD_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C[NH]C(=N2)CC)=O""",21,"""6AF0164D80B346A7""" -"""6D1502F67790E8AC_6C3EF13CE912E1E5_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2CC3CCCC23""",21,"""6AF0164D80B346A7""" -"""72CFC7D55EF88105_E7BBE32C5F434D85_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=CSC=N2""",21,"""6AF0164D80B346A7""" -"""7C19DB6F4B897D01_B5EE019E73DDECC3_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=C[NH]C=C2""",21,"""6AF0164D80B346A7""" -"""E9CA5D1F45972B76_286398233C01B7F5_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=NC=C[NH]2""",21,"""6AF0164D80B346A7""" -"""D230A7C8C70649AF_9C7E19962B1098A2_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=C[NH]N=C2""",21,"""6AF0164D80B346A7""" -"""54771637A87FED77_0372271B6685F86A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2(CC=CC2)C#N""",21,"""6AF0164D80B346A7""" 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-"""EB15134D338B157E_79655BE66AD38CE8_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)[C@@H]2[C@H]3CCCO[C@@H]23""",21,"""6AF0164D80B346A7""" -"""BD3D9C998846D97B_2A78AEBF88FB1130_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(NC)CCCC2)=O""",21,"""6AF0164D80B346A7""" -"""58C16519F8561DDD_01323CC7A17091AE_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C)CC(C2)C#N)=O""",21,"""6AF0164D80B346A7""" -"""B06CCA8D0AF96DDF_82B490ADE3AF9148_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=NC=C(C=N2)F""",21,"""6AF0164D80B346A7""" -"""486F2DCA98A12765_6FFE2771C7CA870F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[N+]2=C[N](C)C=C2)=O""",21,"""6AF0164D80B346A7""" -"""A126D91C98E1D163_C7FB8D2018009F78_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]2NC[C@H](C)OC2)=O""",21,"""6AF0164D80B346A7""" -"""5EF8F7E10D7159E3_8E8CA6745F721033_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C3CCC2(CC2)C3""",21,"""6AF0164D80B346A7""" -"""65885500D905D8E4_6E01B8DE711A72A7_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C)=CC(C)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""36E90F7938B1F112_123DEC9A92F3861A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CC(=C(Br)S2)Cl""",21,"""6AF0164D80B346A7""" -"""3B05FBE1CE0A8322_D6D3844068FFD4D4_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[C@H]2CCCCN2)=O""",21,"""6AF0164D80B346A7""" -"""BFA00D4BA06FBAC9_9D3261C493E2A1DB_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(N(C)C)CC=C)=O""",21,"""6AF0164D80B346A7""" -"""517143F89E025D0C_FD4FE68F25F6C335_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C[N](C)N=C2N)=O""",21,"""6AF0164D80B346A7""" -"""8CB9C7F91CDAFA7F_79849BACA561DA6B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(CC)SC=N2)=O""",21,"""6AF0164D80B346A7""" -"""302C5426A2A7B95C_009ED2D0BC74528A_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC[C@H]2CCCN2)=O""",21,"""6AF0164D80B346A7""" -"""DA7B2C32ED64C43D_530C036F30EC7545_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C[NH]C=C2CC)=O""",21,"""6AF0164D80B346A7""" -"""E6DD6CD05CEFAEC8_CB2C10AB8AF3E422_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CN=C(CO)S2)=O""",21,"""6AF0164D80B346A7""" -"""A539C86769B624CE_F2463B1E318273CC_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2NCCCC2C)=O""",21,"""6AF0164D80B346A7""" -"""152F3537FCBAB1EF_61F9C526404EB521_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NC=CC(=C2)C)=O""",21,"""6AF0164D80B346A7""" -"""4FB6A2F65A74F2F8_278D88C652C025F8_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CC(=C(Cl)S2)Cl""",21,"""6AF0164D80B346A7""" -"""9B4F80E756C64643_4BBE3DC57C81992D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=C(C=N[NH]2)C#N""",21,"""6AF0164D80B346A7""" -"""153B2D3B94AFA630_7C7226D28352D198_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CCC2=CON=C2""",21,"""6AF0164D80B346A7""" -"""EA2FDC4BE2C83DA7_718A46A4DB4115C8_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CN(C)C)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""F4DA19E973F46230_BBDD3B52ECFF63E3_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CCC(C)(C)C#N)=O""",21,"""6AF0164D80B346A7""" 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-"""9AA52C825F77B2DA_AB06E2D390EF9686_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)COCC2CCC2""",21,"""6AF0164D80B346A7""" -"""EFDF2257BC295985_B47A01D45D6DB679_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2C(C)(C)C2(C)C)=O""",21,"""6AF0164D80B346A7""" -"""696159F30A6A358E_02DA5F5DBC28452B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CC=C(C)[N]2C)=O""",21,"""6AF0164D80B346A7""" -"""DCA6014EFFA706E9_DEB643F01E4C10FA_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NC=C(C)C=C2)=O""",21,"""6AF0164D80B346A7""" -"""7F567BC1434DF035_C3AADAB21B18F99E_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[N]2N=C(N)N=N2)=O""",21,"""6AF0164D80B346A7""" -"""0785983BC8778479_913BE70329DF3CE0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CC(=C[NH]2)C#N""",21,"""6AF0164D80B346A7""" -"""01B56CED11E8F283_36173ED70209AA6D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2=CC=C(C)O2)=O""",21,"""6AF0164D80B346A7""" -"""D42053B18D614450_D60D38BF29F13E8B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C)CCCOC2)=O""",21,"""6AF0164D80B346A7""" -"""0C6123B73AD3AC12_820CEE4E7CE8608A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[S](C(C)C)(=O)=O)=O""",21,"""6AF0164D80B346A7""" -"""F91C97782D2DBECD_316E42BDEFAA8DF6_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@]2(C)C[C@H](C2)C#N)=O""",21,"""6AF0164D80B346A7""" -"""BE57071DF859D50E_68A8271BEFBA0B12_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(CCOC2C)F)=O""",21,"""6AF0164D80B346A7""" -"""CD1DDC93FBC96DFF_66CF2A0467A80B2D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C#CC(N(C)C)=O)=O""",21,"""6AF0164D80B346A7""" -"""66C40F88A144783E_03129C2F4E7E2865_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@]2(CNC[C@H]2C)C)=O""",21,"""6AF0164D80B346A7""" -"""FB45A2BF559C2547_DD13E5EF3AAA64F9_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2=CON=C2C)=O""",21,"""6AF0164D80B346A7""" -"""BBD2091AF2F094AB_00141537CD2FF514_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C(F)CC2CCC2""",21,"""6AF0164D80B346A7""" 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-"""ECD5473D53C35D8D_6FC54732B4CE65AE_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CCCOC(C)=O)=O""",21,"""6AF0164D80B346A7""" -"""FC65132F86581F08_926C0ADA0FA0B2AD_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=NC=CO2""",21,"""6AF0164D80B346A7""" -"""F6504B83884C74B5_2229F9F4259367F4_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C)CCCCO2)=O""",21,"""6AF0164D80B346A7""" -"""C39C56E53978B11B_FC43F48223FFF941_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(OC)SC=C2)=O""",21,"""6AF0164D80B346A7""" -"""79CF1A13B7A9EDC8_6BD65D8304418F72_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=COC=N2""",21,"""6AF0164D80B346A7""" -"""240CD8BFBE43CDE1_9727506974833BF1_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C#CC2CCNC2)=O""",21,"""6AF0164D80B346A7""" -"""9F4904FCC3F36AB0_BC7F9D8E601AEDBC_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CC=C[N]2CC)=O""",21,"""6AF0164D80B346A7""" -"""1135473E230A0D03_D9B2F2E8A8A1BCC9_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CCCN(C)C2)=O""",21,"""6AF0164D80B346A7""" -"""16615086A3BD7882_D196BD9F7854050A_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2NCCC2CC)=O""",21,"""6AF0164D80B346A7""" -"""BCDD24DDA3C6237F_C634C89C1B4C79AC_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]2C[C@@H](C)CNC2)=O""",21,"""6AF0164D80B346A7""" -"""4A6D5E4C5B1B73DE_5D35269EB2CE0284_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C(C)C)CCC2)=O""",21,"""6AF0164D80B346A7""" -"""70841F9DC2EA9F93_1465D24DDB0A1506_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]2OC(C)(OC2)C)=O""",21,"""6AF0164D80B346A7""" -"""8E8066321CF1BB47_8D2AA93F035E2CC7_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CO[C@H]2CCNC2)=O""",21,"""6AF0164D80B346A7""" -"""129B8C7639B2E907_A5DF8755B9E4063F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NON=C2CC)=O""",21,"""6AF0164D80B346A7""" -"""4882D068D3C6F014_E7DAE9CA5D0BC182_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CC(C)=O)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""AB698F6A7D84C825_8DB7AB144CA70C27_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CC(CC)(C)C2)=O""",21,"""6AF0164D80B346A7""" 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-"""BD949059A5C74F66_A6E52C6FAD204511_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CO[C@@H]2CCNC2)=O""",21,"""6AF0164D80B346A7""" -"""491E08F2A41ABFFE_F2CF0750CAEC8588_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(N=[S](C)(=O)C)=O)=O""",21,"""6AF0164D80B346A7""" -"""3835472B1672049B_C3461CF3AB57D391_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2=CC=N[N]2C)=O""",21,"""6AF0164D80B346A7""" -"""160208B5093C84A8_495B5F6A46B78B70_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NC(=N[N]2C)C)=O""",21,"""6AF0164D80B346A7""" -"""4F3390220DBD6DC7_323E10B1B61025FD_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2COCCO2""",21,"""6AF0164D80B346A7""" -"""9D32D1D48A3A98A0_8FBB5B5EA38B6420_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2C3(CCN2)CC3)=O""",21,"""6AF0164D80B346A7""" -"""8C9994E06DB78BD3_B03BFD36DAC6C399_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]2CC[C@@H](C)CN2)=O""",21,"""6AF0164D80B346A7""" -"""16751716ADA92BFF_0458C1BA69A2ACCA_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]2CC[C@@H](C)NC2)=O""",21,"""6AF0164D80B346A7""" -"""A93AB777AAB3CA3F_C5E2F1C94868BB6A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C)C[S](=O)(=O)C2)=O""",21,"""6AF0164D80B346A7""" -"""D803CF617D1928A1_B4C3AF43142ABB05_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2CC[C@H](OC)C2)=O""",21,"""6AF0164D80B346A7""" -"""BDB764BFB8D61895_87BBD18181656938_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[C@@H]2C[C@H](CN2)F)=O""",21,"""6AF0164D80B346A7""" -"""0B145FA4EA1950C0_475C133A24C0DD66_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CC=N[N]2C=C""",21,"""6AF0164D80B346A7""" -"""2046E702D6B2C25A_7EAA382463BC8AAB_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=N[N](CC)C=N2)=O""",21,"""6AF0164D80B346A7""" -"""18BC29FE2FF6CE2F_C1083CB4F827D940_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2COCCN2)=O""",21,"""6AF0164D80B346A7""" -"""24F339BF0C2E9107_72E595047078D627_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=NC(=C(Cl)S2)Cl""",21,"""6AF0164D80B346A7""" -"""88C75C633EF42E15_B3A8098329611DAC_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=C(C(=CS2)Br)Br""",21,"""6AF0164D80B346A7""" -"""268156FAAD802117_BA975846DCC0DAA0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(C)OC(=N2)C)=O""",21,"""6AF0164D80B346A7""" -"""22744666C882BE5F_BB4DD284FD6748B7_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(C=C(C)S2)C)=O""",21,"""6AF0164D80B346A7""" -"""3EDF027353145AED_88B6F6EC1A54B072_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=CN=CS2""",21,"""6AF0164D80B346A7""" -"""FDE214BBF61A46F7_35EA158A209B9BD6_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2(CC=C)CCC2""",21,"""6AF0164D80B346A7""" -"""A540DCD059470B51_A9FF77420BD4E6BD_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=NOC(=C2)CF""",21,"""6AF0164D80B346A7""" -"""9F797F455B42EA8A_B64AA9C5664FAE58_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CC(CC)C)C)=O""",21,"""6AF0164D80B346A7""" -"""D6EACA77D6712ECD_E13303724883AF50_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(COCCN(C)C)=O""",21,"""6AF0164D80B346A7""" -"""B963C1AC977926BF_53EBBC202234788C_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CCC2=CN=CO2""",21,"""6AF0164D80B346A7""" -"""FB9115F2E612E0F6_7583DB1A4CEA02A0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CSC=C2CC)=O""",21,"""6AF0164D80B346A7""" -"""34344BD498CB95BB_132158EF139C712B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC(C)(C)CC=C)=O""",21,"""6AF0164D80B346A7""" -"""407262FAC370C29F_5232762AC74CB268_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C(F)[N]2C=CC=N2""",21,"""6AF0164D80B346A7""" -"""FD2AEACEBE91A37D_2B634ED08B8F9E0E_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[N]2N=C(C)N=C2)=O""",21,"""6AF0164D80B346A7""" -"""DF6A02514BABDA71_179754D52D78ADE8_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2(F)CCCOC2""",21,"""6AF0164D80B346A7""" -"""9B6A1AA53A927A63_D53AE60314FB098D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C23N(C)CC(C2)C3)=O""",21,"""6AF0164D80B346A7""" -"""E808C9D41F0E9D5F_5E7CD8D4224F629D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(N(C)CCC2)C)=O""",21,"""6AF0164D80B346A7""" -"""C411B8502BCC1707_5C460356A18B2A13_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CN=C(N)N=C2)=O""",21,"""6AF0164D80B346A7""" -"""ABE4538255501415_07721FBB11D89993_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CC)(C)COC)=O""",21,"""6AF0164D80B346A7""" -"""63E3A0D97516432A_0A858D7B5B90A629_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(OC)CCSC)=O""",21,"""6AF0164D80B346A7""" -"""721872A41CE18BE3_6C274C15C4E00460_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)[C@H]2C[C@@H](C2)N=[N]#N""",21,"""6AF0164D80B346A7""" -"""9BC171668D2BDE70_79F71C9BF189F580_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C#CC2(C)COC2)=O""",21,"""6AF0164D80B346A7""" -"""D82165A66787FAC3_DF7EDE93B3DBE731_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(C)C=C(S2)N)=O""",21,"""6AF0164D80B346A7""" -"""6CC1A70A3D2C8C7B_84FBF1F81AE7B6C5_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2C(C)(C)C(C2)=O)=O""",21,"""6AF0164D80B346A7""" -"""040195F155F1B8E2_1F7DDD156AD07CA0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C23CC(C)(C2)OC3)=O""",21,"""6AF0164D80B346A7""" -"""0D0C3EA1F3948C0B_6423C14C4AB3A1C5_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=NOC(=C2)C#N""",21,"""6AF0164D80B346A7""" -"""4C9E8811AACDA1FA_D493CF382F5F2CB2_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C23CC(C)(C2)CO3)=O""",21,"""6AF0164D80B346A7""" -"""34189B2E874E26A3_857B77F4D0C74023_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C[C@H]2CCC=CC2""",21,"""6AF0164D80B346A7""" -"""9FF0D43F6B116568_B2EABE13D9FF3A5B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=NN=C[NH]2""",21,"""6AF0164D80B346A7""" -"""3190EF938FBA4C0D_7FEB2CA927E2A9B4_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]2CCC[C@@H](C)N2)=O""",21,"""6AF0164D80B346A7""" 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-"""B7343A0EAEB8A648_E14FA93125646ECF_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[N]2N=NN=C2C)=O""",21,"""6AF0164D80B346A7""" -"""A417D59D4DA674ED_6BC9101DAB9FE98C_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NOC(=C2C)N)=O""",21,"""6AF0164D80B346A7""" -"""4E7BBAEAD08239A8_5D7B41B831BF3CC7_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CC(=C[NH]2)CC)=O""",21,"""6AF0164D80B346A7""" -"""2F0990FE6209AEFB_52AD464ABDC19EAE_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2CCCO2""",21,"""6AF0164D80B346A7""" -"""EBAD806FE9642EA1_77E5291D235D1746_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CN3CC2CC2C3""",21,"""6AF0164D80B346A7""" -"""8C930405A8AFE436_F762EF208C4BD2B0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2OCCC2C)=O""",21,"""6AF0164D80B346A7""" -"""8C7F907460FA442C_5453A351BEF53382_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2(C)CCCO2)=O""",21,"""6AF0164D80B346A7""" -"""231406F8991F332C_E14BE32CC86F99A8_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[C@H]2CCCNC2)=O""",21,"""6AF0164D80B346A7""" 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-"""023A9FD3BE9D938A_F69C10AC6AC7786C_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NC=N[N]2CC)=O""",21,"""6AF0164D80B346A7""" -"""547E395C46715361_4AC67A6FAA8C53B5_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC3CC2CC2C3""",21,"""6AF0164D80B346A7""" -"""E293A0868DABE3D3_68F999BF5A155C7B_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2C3(CN2)CCC3)=O""",21,"""6AF0164D80B346A7""" -"""4F8CF446FCFE4B26_CFAFA4AD13992767_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]3[C@H]2CC[C@H]2CN3)=O""",21,"""6AF0164D80B346A7""" -"""E8E02702ED619F79_0C02B75261EDF7C0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CN=CC(=N2)N)=O""",21,"""6AF0164D80B346A7""" -"""1E456253D51A67E2_E038D76FC638A1C0_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CCCOCCC)=O""",21,"""6AF0164D80B346A7""" -"""C4E96D2C494C4404_D42A07F7887EF505_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(CC2(C)C)C#N)=O""",21,"""6AF0164D80B346A7""" -"""E5037B1F04C8FDEA_D7C0479749B51F1F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2(CC2)C3CC3""",21,"""6AF0164D80B346A7""" -"""41B6DCC97D8D1940_75149EE38F0E7291_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C3CC2(CC2F)C3""",21,"""6AF0164D80B346A7""" -"""5EB293A75198A075_3D1CDAA9920E6856_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C23CCC(C2)OC3""",21,"""6AF0164D80B346A7""" -"""E85CF12A4B1C30B2_0DD17968CD70429B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CCC(C)C(=O)C)=O""",21,"""6AF0164D80B346A7""" -"""A2CB098AC8E6A353_4EB34726BC08BC00_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2[S](=N)(CCC2)=O)=O""",21,"""6AF0164D80B346A7""" -"""4115A41F246BAF45_6B772310136DD677_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C([N](C)N=N2)N)=O""",21,"""6AF0164D80B346A7""" -"""41705C2790FCFB08_534272DEE94484C9_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2(CCNC2)C)=O""",21,"""6AF0164D80B346A7""" -"""130981613C454F2B_2078D1F60A23AFFC_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@]23C[C@@H](OC)[C@@H]2C3)=O""",21,"""6AF0164D80B346A7""" -"""3BA6DA5DC42D9C47_6868C91ECA4EB6EB_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2NC(CC2)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""64DF581F16DAC87D_65454B61168FC94F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2N(O)CCCC2)=O""",21,"""6AF0164D80B346A7""" -"""64CB677B8BA1A348_4B5371A91F6FDA9B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2(CC2)C3CCC3""",21,"""6AF0164D80B346A7""" -"""B26E30742631BED2_DE2A6D417B9D827E_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C(C)(C)F)(C)F)=O""",21,"""6AF0164D80B346A7""" -"""CD61509836976CD7_47CC08C5E75F6F40_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CCNC2(C)C)=O""",21,"""6AF0164D80B346A7""" -"""E4735B60916714C1_BC59D14D56C38E77_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2C3C4CC2CC34""",21,"""6AF0164D80B346A7""" -"""27DA7DE0CC41E637_C67E1F4942BA0316_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]2C[C@@H](CC)CN2)=O""",21,"""6AF0164D80B346A7""" -"""F475C3B010F91569_22848E50E7EABF45_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2NCCO[C@H]2C)=O""",21,"""6AF0164D80B346A7""" -"""E97F42112042F91B_2686D5474416FC8D_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2(OC)CNC2)=O""",21,"""6AF0164D80B346A7""" -"""64CBD893BCAF80C0_892217766822CF4E_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C)C2=NC=CS2)=O""",21,"""6AF0164D80B346A7""" -"""DC6BC434FAFC157C_222B2253C579A576_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C)(C)CCC#N)=O""",21,"""6AF0164D80B346A7""" -"""36BD062BE364C773_CF2593B67B5E165B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C23CC(CC)(C2)C3)=O""",21,"""6AF0164D80B346A7""" -"""2E20FED065C4D627_D96536B48775DCF7_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C)OC2COC2)=O""",21,"""6AF0164D80B346A7""" -"""905F0B72C4460779_21E4E1D455425920_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2CNC[C@@H](C)O2)=O""",21,"""6AF0164D80B346A7""" -"""D46F6123439F594C_36239AAD4A396E12_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CCNC23CC3)=O""",21,"""6AF0164D80B346A7""" -"""8098945DC7407BDD_87FF2141C4201823_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(OCCCC)=O)=O""",21,"""6AF0164D80B346A7""" -"""30A2847A21F50240_2BB98C31010914F2_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NOC(C)(C)C2)=O""",21,"""6AF0164D80B346A7""" -"""477B77DB1F27656E_C87770067A51FE33_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(C)CCCC=C2)=O""",21,"""6AF0164D80B346A7""" -"""1FAA64783EB10F25_85FB7BF04E1F443D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(C)C=C(S2)F)=O""",21,"""6AF0164D80B346A7""" -"""3D5920AA8C9479E8_5E7CA34B063875CD_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2C[C@@H](N(C)C)C2)=O""",21,"""6AF0164D80B346A7""" -"""18B0C5C5ED1BF1AA_C96FE22BB9101771_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CCC)CCC)=O""",21,"""6AF0164D80B346A7""" -"""694CFE6C7AA7A548_352E4E2B2263BF3B_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CC=C(C#C)O2""",21,"""6AF0164D80B346A7""" -"""9F007D3F67E78C90_0E1ADBFAC10F61EC_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C[N](C(=C2)C)C)=O""",21,"""6AF0164D80B346A7""" -"""E1CFC7CA28D533EB_38F111483109C578_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CCC(CN2)F)=O""",21,"""6AF0164D80B346A7""" -"""E4945DB40BC3CAF1_87480CE8F4967B84_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CC(C)SCC2)=O""",21,"""6AF0164D80B346A7""" -"""0A0A67BB6F31851E_DF44736B36564ABA_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NN=C[N]2CC)=O""",21,"""6AF0164D80B346A7""" -"""8ABA9456CD81598E_D654B7F24AE07AF6_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CC(=C(Cl)S2)Br""",21,"""6AF0164D80B346A7""" -"""DFC1015E83A4ADD1_E7408B00A022B5FC_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CN(C(N)=O)C2)=O""",21,"""6AF0164D80B346A7""" -"""97FA366BCBC46919_AD380977FEB672EB_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)[C@@H]2C[C@@H]3CC[C@H]2O3""",21,"""6AF0164D80B346A7""" -"""47366FF2B0D4C06C_EEEDDDC21BC69C11_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2CC[C@@H](CC)O2)=O""",21,"""6AF0164D80B346A7""" -"""5662603E617CE038_90E3F64D1419F879_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(COC)CNC2)=O""",21,"""6AF0164D80B346A7""" -"""072752103DD90745_BF4837DE7CD883D7_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2[C@@H]3CCCC[C@H]23""",21,"""6AF0164D80B346A7""" -"""EA5E8B11BDBB40A2_F31FB4B73BB1DED9_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2OCC(C)(C)C2)=O""",21,"""6AF0164D80B346A7""" -"""E79E2F354934F2B3_941085008269702C_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2NC3(C2)CCC3)=O""",21,"""6AF0164D80B346A7""" -"""DD6A57467F00D430_4991EDD047150E53_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@H]2CN([C@H](C)C2)C)=O""",21,"""6AF0164D80B346A7""" -"""1256F8AE53FA1F58_634570735F926CD3_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(COC2CCNC2)=O""",21,"""6AF0164D80B346A7""" -"""D6D0DE3FAC5E1CFE_B5E4875B2136346F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CN(O)C(C2)=O)=O""",21,"""6AF0164D80B346A7""" -"""F3BD309BEE4D8D78_470FF66B4B2E5EF5_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NN=C(N)C=C2)=O""",21,"""6AF0164D80B346A7""" -"""D80D81636BC6BA40_17375DD9A7522220_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(CC2CNC2)F)=O""",21,"""6AF0164D80B346A7""" -"""388D4089DB3ECBF2_A99DBD3EF5B7B5BF_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C3CC2(CC2)CO3""",21,"""6AF0164D80B346A7""" -"""AD86A8344483094F_DFCB3720C3F6AECE_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(OC)C2CNC2)=O""",21,"""6AF0164D80B346A7""" -"""9AE853472BDD840B_0088011FB7249126_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2(CC(C)=O)CC2)=O""",21,"""6AF0164D80B346A7""" -"""19F682D65D6DCBE8_4A36AB164F8CC071_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C[C@@H]2C[C@H](OC)C2)=O""",21,"""6AF0164D80B346A7""" -"""6BB7CBA1343F4926_E63524182370E03D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(N=C[N]2C)N)=O""",21,"""6AF0164D80B346A7""" -"""8314EF01C12979E0_2BEEE13D206C9667_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C(CC)C)NC)=O""",21,"""6AF0164D80B346A7""" -"""22CB3443CA09FA4F_4B7FADB428CA73B0_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@@]23C[C@@]2(CNC3)C)=O""",21,"""6AF0164D80B346A7""" -"""41373E249187E800_01A6A458E9506716_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(F)CNCC2)=O""",21,"""6AF0164D80B346A7""" -"""79C75C1FC5670D9F_8C7682C8E91EBDEF_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C=CC2=CCCC2""",21,"""6AF0164D80B346A7""" -"""83812DDAB21354F7_8D3A9D6245C28927_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2=C(C)[NH]N=C2)=O""",21,"""6AF0164D80B346A7""" -"""6A72D266205B5127_F0A81BF196BFC11A_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CN=C(SC)S2)=O""",21,"""6AF0164D80B346A7""" -"""8CAC8795A05E8462_7132CAF4246CF9AE_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC3CC2(CC2)C3""",21,"""6AF0164D80B346A7""" -"""9F397185E3456D6C_E4B5ECC46DF57E9B_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C23CCC(CN2)C3)=O""",21,"""6AF0164D80B346A7""" -"""0BADA4D4F65B8004_9AC64FDF2B9C178E_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2NCCNC2)=O""",21,"""6AF0164D80B346A7""" -"""EF06E1C468F5BC0F_A7B678E47F446B94_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@H]3[C@@H]2CC[C@@H](N2)C3)=O""",21,"""6AF0164D80B346A7""" -"""CFB019AF0569C469_89E673D906E2135A_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CC2=CCNCC2)=O""",21,"""6AF0164D80B346A7""" -"""7309D093D065AC7C_C1D6BC715489B838_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CC[Si](C)(C)C2)=O""",21,"""6AF0164D80B346A7""" -"""AA93FEF1D329AA35_501B45306329E8A3_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2CCOC2=O""",21,"""6AF0164D80B346A7""" -"""6C0A12C3A0EE60AC_EEFFC211FE339099_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CC(C)OC2=O)=O""",21,"""6AF0164D80B346A7""" -"""BAC76510B777DCA4_A1488438995B2556_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=CSC(=N2)CC)=O""",21,"""6AF0164D80B346A7""" -"""B87760171C0C87D1_E596C50778497C60_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2CC3(C2)COC3""",21,"""6AF0164D80B346A7""" -"""7413C4BBB31083E7_646154A8C432CA21_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CCC=CC(C)C)=O""",21,"""6AF0164D80B346A7""" -"""551542880504B3D2_5B9D597EE88833E4_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=NC=CC(=O)N2""",21,"""6AF0164D80B346A7""" -"""6D8A09E5050029CB_14DE43F9D681066F_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2=CC(=C(Br)[NH]2)Br""",21,"""6AF0164D80B346A7""" -"""3543963128B4041A_4703FC502F25F7AF_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC[C@H]2CCCO2""",21,"""6AF0164D80B346A7""" -"""CF02610C44996854_5849D4FC0534FFD6_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)COCCCC#C""",21,"""6AF0164D80B346A7""" -"""3AE915689F1AA902_F2BA8B9C6503A10D_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C(OC)=O)(C)F)=O""",21,"""6AF0164D80B346A7""" -"""D9DD5321FC827AE4_657F40A00EE00E6E_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2C[Si](CN2)(C)C)=O""",21,"""6AF0164D80B346A7""" -"""E35273AB36BC2381_472A153B64B41345_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=N[NH]C=C2OC)=O""",21,"""6AF0164D80B346A7""" -"""1610DAA8E70BEA60_22017FFCDC5BC6AF_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2CC[C@@H]3CC[C@H]23""",21,"""6AF0164D80B346A7""" -"""7E481CBA114D26FD_F904CFE8B2390523_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C(C)C2CCNC2)=O""",21,"""6AF0164D80B346A7""" -"""051346A165063ACA_1AC7B2E9FCC3FFA7_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C3C2CC2C4CC34""",21,"""6AF0164D80B346A7""" -"""B14A3EDAE40E910D_94228E5DE4AB3D5C_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NO[C@@H](C)[C@@H]2C)=O""",21,"""6AF0164D80B346A7""" -"""59E68BC0CD313A3D_E21B08C400E1EEEC_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C=CC2=CC=C[NH]2)=O""",21,"""6AF0164D80B346A7""" -"""40FBC4B75128C381_D24F1C5625BAE1B1_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)[CH]3C[C](=[C]2CC2)C3""",21,"""6AF0164D80B346A7""" -"""E5370D5628269831_EC5482A8CE263D43_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C([C@]23C[C@@H](OC)[C@H]2C3)=O""",21,"""6AF0164D80B346A7""" -"""77021EFBFBBCD756_5043095052955F00_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)C2CCC23CCC3""",21,"""6AF0164D80B346A7""" -"""06DD1CF4E17C2D0E_A6DEB26D78C42D9B_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(CCC2(CNC2)C)=O""",21,"""6AF0164D80B346A7""" -"""3E19F9E57CBB60F0_531154538EF025DC_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2=NN=CC=C2""",21,"""6AF0164D80B346A7""" -"""156F3BE5CF4A71C0_27058B76633689D6_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2=CC=NC=C2""",21,"""6AF0164D80B346A7""" -"""1D54EBBADBBF4DD9_384245D4E2C49F68_6038_DP""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2CCNCC2C)=O""",21,"""6AF0164D80B346A7""" -"""4BBB969B9D0282AC_6625B23BAA309AE3_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(=O)CC2CSCCS2""",21,"""6AF0164D80B346A7""" -"""64621841D4BD036C_B3B17C299D80A195_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=NN=C(CC)[NH]2)=O""",21,"""6AF0164D80B346A7""" -"""2CA69AACD6BBE385_48863B196F385A66_6038_UN""","""N(CCCC1=C(C(=CC=C1)F)Br)C(C2=C(CC)[NH]N=C2)=O""",21,"""6AF0164D80B346A7""" 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+"""E28062A68964277B_4E633B13BE1D6D21_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2CCCC2(F)F""",21,"""03DD48269C270BDF""" +"""0556D5F9D77406D2_C8FA9C3E9FE70FB3_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OC[CH]3C[C]2(C[CH2]C2)C3""",21,"""03DD48269C270BDF""" +"""8385861CDBF82100_21129D5AEE4BB932_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCCCCC#C""",21,"""03DD48269C270BDF""" +"""2B3A2E0FAE163817_43ABE77C73FAA735_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC(C(CC)C)OC""",21,"""03DD48269C270BDF""" +"""8DF3193AB78D58B4_B966F3A5064FB196_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCC(C)(C)CN""",21,"""03DD48269C270BDF""" +"""A3FD8EDBB5308234_E54A8930EB1C64C7_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=CC(=CC=C2)Br""",21,"""03DD48269C270BDF""" +"""680C43AE97EDC07B_79D71863A26174B0_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCCC(F)(F)F""",21,"""03DD48269C270BDF""" +"""FA5BC876005D97B1_7BA96413A9F626C4_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=C(C)C=CC=C2""",21,"""03DD48269C270BDF""" 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+"""3036282F5105E285_909D9455A06BE820_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=NN=C(CC)S2""",21,"""03DD48269C270BDF""" +"""09939D6705F604C2_6B9DA43F7E7412AF_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCC(CCC)C""",21,"""03DD48269C270BDF""" +"""D18CF69CFC09D755_7103934B9BE21E0F_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2NCCN(C)C2""",21,"""03DD48269C270BDF""" +"""FB0BA5AB3040BEE6_8FDE5A93411BF461_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OC[C@@H]2C[C@H](C)CCN2""",21,"""03DD48269C270BDF""" +"""2B56BF2F6514BA16_ED6AD737DB3C77D9_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCC2=CC=CO2""",21,"""03DD48269C270BDF""" +"""EC7EC563E06A5FF3_B1AB5E8C7A7240AC_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=NC=CC(=C2)N""",21,"""03DD48269C270BDF""" +"""10B30E8D09F209AF_CC8BDEA43109FDAD_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2(C)COC(=O)N2""",21,"""03DD48269C270BDF""" 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+"""8CC93860B4A63BFB_FCF17C655F81FF93_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=N[N](C=C2C)C""",21,"""03DD48269C270BDF""" +"""1F82FE02496EFB95_C1F9398B4BD08454_6031_DP""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC23CC(CN)(C2)C3""",21,"""03DD48269C270BDF""" +"""870BA1D305D8CE4F_FB4F80CD174C9885_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCOC2CCOC2""",21,"""03DD48269C270BDF""" +"""74D4CBE352F2B7B6_D325E8BF1BD35DDE_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=C[N](CC)N=N2""",21,"""03DD48269C270BDF""" +"""2DE010BF8E5CDCBC_C40F5D2314C22F4D_6031_DP""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=CN=C(CN)S2""",21,"""03DD48269C270BDF""" +"""CDDCDC62FF27E01A_2D4E3569C42E7B11_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2(CC2(C)C)CN""",21,"""03DD48269C270BDF""" +"""91CA7667C54F290E_3D2AE2C600E797F1_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OC[CH]=[C]2CC[CH2]CC2""",21,"""03DD48269C270BDF""" 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+"""A4FE90BD48A2D573_3C24FE6BCF795833_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCNC(NC)=O""",21,"""03DD48269C270BDF""" +"""082F0BF367F05CFD_A03CE2D445B254DC_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2(CC=C)CCC2""",21,"""03DD48269C270BDF""" +"""2B1AC751AF5899B6_A8C6E9E08F481D87_6031_DP""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OC[C@@H]2CC[C@H]2C(O)=O""",21,"""03DD48269C270BDF""" +"""6CBD14CDEA55659D_D6F845A7D5D2ADC2_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC(CN)C(F)(F)F""",21,"""03DD48269C270BDF""" +"""03C532477ED11A7C_47380271801563B6_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCC2CC2(C)C""",21,"""03DD48269C270BDF""" +"""1FF9BC382C1D94A2_70DD3D57434093F1_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=C(C)N=C(S2)Cl""",21,"""03DD48269C270BDF""" +"""2341DC2D4DFB7E41_6F700A963155259C_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCOC2CCC2""",21,"""03DD48269C270BDF""" +"""71612975E38A7ECF_5394927E0F1CE5FB_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2(C(C)C)COC2""",21,"""03DD48269C270BDF""" 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+"""6F6163D5DA5066E3_333B5DF7C5E9551C_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCOCC(F)(F)F""",21,"""03DD48269C270BDF""" +"""AA9427BEC877B809_C9B83F35DB7BBBD7_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=NC=C(C=C2)Br""",21,"""03DD48269C270BDF""" +"""9132928E08554DFA_C2E7C9D89083D67C_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=NC(=CC=C2)Br""",21,"""03DD48269C270BDF""" +"""BF128931F1672050_9289D7828E0D9B7E_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2CNCCC2C""",21,"""03DD48269C270BDF""" +"""DE7C7D702847113B_2B988E13D4D87666_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCC[S](=O)(=O)O""",21,"""03DD48269C270BDF""" +"""33958213D745D864_80FCD1610699F18B_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCCCN(C)C""",21,"""03DD48269C270BDF""" +"""D8DC7E9A3115D33B_94842059D411A5AC_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=CN=C([N]2C)S""",21,"""03DD48269C270BDF""" +"""FF28EB09F4F1D74D_E220982B344806F5_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2=C[N](N=C2C)C""",21,"""03DD48269C270BDF""" +"""B529385B637C6203_B4D90524968DBD51_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCC(CC)(N)CC""",21,"""03DD48269C270BDF""" +"""DDF0D1375E7D415E_4458F204C674F3C7_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2CCCC(F)C2""",21,"""03DD48269C270BDF""" +"""A00D29CB02934A2C_227058492C35BE1B_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCC2=CC=CC=C2""",21,"""03DD48269C270BDF""" +"""5045EC48CECE04F0_E437FAEC0FABBF56_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCC(C)(C)C#N""",21,"""03DD48269C270BDF""" +"""0EF02EFA620463DD_94F41A4F426B5396_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCCCCC(C)N""",21,"""03DD48269C270BDF""" +"""BEAE821914F4E5DB_9B0D2CC899C77C7C_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC2COCCN2C""",21,"""03DD48269C270BDF""" +"""89F178FB11F65085_77E583A839E1F14C_6031_UN""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCC(C)(N)CC(F)F""",21,"""03DD48269C270BDF""" +"""974574E1F6EA04BE_469D3849AEBA2B53_6031_DP""","""COC1=C(C=C(C(=C1)Br)Cl)C(=O)OCCOCCC(O)=O""",21,"""03DD48269C270BDF""" 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