Spaces:
Sleeping
Sleeping
| SMILES,Yield_Strength_GPa,SA_Score,Degradable,Rank_Score | |
| *Oc1ccc(-c2ccc(C(*)=O)cc2)c(S(=O)(=O)O)c1,0.11880616,1.8436395718491738,No (Stable Backbone),0.2662418090384868 | |
| *c1ccc(-c2ccc(*)cc2C)cc1,0.094185434,1.3815276242984211,No (Stable Backbone),0.2510905455702108 | |
| *NS(=O)(=O)c1ccc(-c2ccc(C(*)=O)cc2)cc1,0.10053724,1.6642520191676624,No (Stable Backbone),0.17324639546835385 | |
| *Oc1ccc(S(=O)(=O)c2ccc(C(*)=O)cc2)cc1,0.086838424,1.6098920191676616,No (Stable Backbone),0.06343823247396951 | |
| *Oc1ccc(Nc2ccc(Oc3ccc(-c4ccc(*)cc4)cc3)cc2)cc1,0.08078052,1.6469956840132252,No (Stable Backbone),-0.015692661456990997 | |
| *Oc1cccc(Oc2ccccc2)c1*,0.06242448,1.5067300806995032,No (Stable Backbone),-0.1291202311990558 | |
| *Oc1ccccc1C(=O)Oc1ccc(-c2ccc(OC(*)=O)cc2)cc1,0.06280982,1.7929671206791813,Yes (Ester/Amide),-0.2683853705088106 | |
| *CCCCCOc1ccc(-c2ccc(C(*)C)cc2)cc1,0.04273905,1.604167313230711,No (Stable Backbone),-0.37469317061338714 | |
| *COc1ccc(CCCCCCCCc2ccc(O*)cc2)cc1,0.043888878,1.6689930696856,No (Stable Backbone),-0.39560774661953335 | |
| *OCCOc1ccc(Oc2ccc(Oc3ccc(C(=O)c4cccc(*)c4)cc3)cc2)cc1,0.057253607,1.996672001513927,No (Stable Backbone),-0.42579994948361755 | |
| *CCCCCOc1cccc(Oc2ccc(Oc3ccc(OC(=O)c4ccc(O*)cc4)cc3)cc2)c1,0.05957857,2.1012440749949306,Yes (Ester/Amide),-0.4548363004598066 | |
| *Oc1ccc(Oc2ccc(C(c3ccccc3)c3ccc(C(*)=O)cc3)cc2)cc1,0.06919098,2.3326375437525257,No (Stable Backbone),-0.47440898183720037 | |
| *Oc1ccc(/N=N/c2ccc(Oc3ccc(OC(=O)c4ccc(C(*)=O)cc4)cc3)cc2)cc1,0.062391795,2.222035464160234,Yes (Ester/Amide),-0.48709979480136933 | |
| *CCOCCOCCOc1ccccc1-c1ccccc1Nc1ccccc1-c1ccccc1,0.06248865,2.2240880272863706,No (Stable Backbone),-0.4871575008868376 | |
| *Oc1ccc(C(O)COc2ccc(-c3ccc(*)cc3)cc2)cc1,0.057702757,2.1561446917113862,No (Stable Backbone),-0.5010447865752976 | |
| *CCOCCOc1ccc(OCCCCCOc2ccc(-c3ccccc3)cc2)cc1*,0.050672106,2.0454431072537904,No (Stable Backbone),-0.5160004742773774 | |
| *OC(C)c1ccc(C(=O)c2ccc(C(*)=O)cc2)cc1,0.05949419,2.256027858460282,No (Stable Backbone),-0.5330720151485675 | |
| *c1cc(OCCCCC)cc(*)c1C,0.03298053,1.7516062895356228,No (Stable Backbone),-0.5459978302269484 | |
| *c1ccc(N(C)c2ccc(Sc3ccc(-c4ccc(N=*)cc4)cc3)cc2)cc1,0.06005884,2.3948793377779776,No (Stable Backbone),-0.596851287598553 | |
| *CCCCOc1ccc(Sc2ccc(Oc3ccc(N=*)cc3)cc2)cc1,0.04733894,2.261267769803375,No (Stable Backbone),-0.6572444977709502 | |
| *Oc1cccc(NC(=O)C(C)O[Si](C)(C)c2ccccc2C(=O)c2ccc(*)cc2)c1,0.07309494,2.869836118414689,Yes (Ester/Amide),-0.7039686573518757 | |
| *CCCCOc1ccc(C(C)c2ccc(OCCCCCCOc3ccc(-c4ccc(*)cc4)cc3)cc2)cc1,0.05225656,2.5562343442916795,No (Stable Backbone),-0.7555515688896142 | |
| *CCCCCC[Si](*)(C)c1ccc(/N=N/c2ccccc2)cc1,0.046459988,2.519280295628814,No (Stable Backbone),-0.7950402702185055 | |
| *C(*)c1ccc(C(CC)(CBr)c2ccc(Cl)cc2)cc1,0.04972442,2.6932153916167803,No (Stable Backbone),-0.8493635165595803 | |
| *NN=C(Oc1ccc(*)cc1)Oc1c(Cl)ccc(F)c1F,0.051255036,2.7327634580694813,No (Stable Backbone),-0.8538313750308344 | |
| *CCCCC(*)(C)CCl,0.030728513,2.4025374140127926,No (Stable Backbone),-0.89398357698244 | |
| *CCCCCCC(C)CCCCCO*,0.021291733,2.31029154626769,No (Stable Backbone),-0.9422284452529857 | |
| *CCCCCCNC(=O)C(C)CC(c1ccccc1)CCCCCC(=O)N*,0.044659402,2.9725763398760314,Yes (Ester/Amide),-1.0396941402730224 | |
| *C(*)C(C)S(C)(C)C,0.03211879,3.520344264958103,No (Stable Backbone),-1.4389842190612354 | |
| *C#C/C=C/CO*,0.031742167,3.603847491154081,No (Stable Backbone),-1.484502070848647 | |