smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C(=Nc1ccccc1)=NC1CCCCCC1 606227891 LZZBGBZRQLNBPM-UHFFFAOYSA-N 214.312 4.215 70 40 BIIB Cc1ccc2ccccc2c1C(=O)C(C)(C)C 160808532 YNSCXLOSNVVGDW-UHFFFAOYSA-N 226.319 4.377 70 40 BIIB Cc1ccc(-c2cc(-c3cccs3)no2)cc1 216666567 SXFLNWDOBFJDDK-UHFFFAOYSA-N 241.315 4.379 70 40 BIIB C[C@H](C[Si](C)(Cl)Cl)c1ccccc1 195751318 OVUWGCLZOZCJBA-SECBINFHSA-N 233.214 4.340 70 40 BIIB C[Si](C)(Cl)c1ccc(-c2ccccc2)cc1 195751148 WLLRGLQEXSPNJJ-UHFFFAOYSA-N 246.813 4.005 70 40 BIIB C[C@@H](C[Si](C)(Cl)Cl)c1ccccc1 195751317 OVUWGCLZOZCJBA-VIFPVBQESA-N 233.214 4.340 70 40 BIIB C[Si](C)(Cl)CCc1cccc(CCl)c1 198364315 VJJQWSQPPVXOJA-UHFFFAOYSA-N 247.241 4.412 70 40 BIIB CCCCCC[Si](C)(Cl)c1ccccc1 198081687 YCAAMDYFQRZLBR-UHFFFAOYSA-N 240.850 4.288 70 40 BIIB C[Si](Cl)(Cl)CC[C@@H]1CC=CCC1 195766690 GIVCFIPFCVYUQZ-SECBINFHSA-N 223.219 4.282 70 40 BIIB C[Si](C)(Cl)CCC[Si](C)(C)Cl 196736294 XJYPEWPGZBASNR-UHFFFAOYSA-N 229.299 4.264 70 40 BIIB Cc1ccc(CC[Si](C)(Cl)Cl)cc1 195792129 IANFZVVVYPCBTJ-UHFFFAOYSA-N 233.214 4.087 70 40 BIIB Cc1ccc(-c2cc(-c3cccs3)n[nH]2)cc1 216696651 YHFIKZNJXLDRBA-UHFFFAOYSA-N 240.331 4.114 70 40 BIIB Cc1cccc(-c2ncc(-c3cccs3)[nH]2)c1 216627737 IKEHKALQUUHKRZ-UHFFFAOYSA-N 240.331 4.114 70 40 BIIB C[Si](C)(Cl)CCCc1ccccc1 195766933 ASSMBLOISZSMMP-UHFFFAOYSA-N 212.796 4.063 70 40 BIIB Cc1ccc(-c2cnc(-c3cccs3)[nH]2)cc1 216626950 CFEIHTGEUVPLIV-UHFFFAOYSA-N 240.331 4.114 70 40 BIIB CC[Si](C)(Cl)[C@H](CCl)c1ccccc1 604939333 QFRLWSUYACLBQH-YNODCEANSA-N 247.241 4.382 70 40 BIIB Cc1ccc(-c2ncc(-c3cccs3)[nH]2)cc1 216628089 DLXQHFCVFIHNAP-UHFFFAOYSA-N 240.331 4.114 70 40 BIIB CC[Si](C)(Cl)[C@@H](CCl)c1ccccc1 604939334 QFRLWSUYACLBQH-ZSOXZCCMSA-N 247.241 4.382 70 40 BIIB Cc1ccccc1-c1cc(-c2cccs2)n[nH]1 216696501 IYDJKKUFJRDDAI-UHFFFAOYSA-N 240.331 4.114 70 40 BIIB CC[Si](C)(Cl)C[C@@H]1C[C@H]2C=C[C@H]1C2 201092540 NVCZXBYGFNJABR-BGJXXYSSSA-N 214.812 4.033 70 40 BIIB CCCCCCCCCCCCC[SiH3] 204947412 IRMAKEFZDCJETQ-UHFFFAOYSA-N 214.469 4.081 70 40 BIIB CC[C@H](CC[SiH](C)C)c1ccccc1 195766549 XYEYZGZSYOUCIF-GFCCVEGCSA-N 206.405 4.057 70 40 BIIB C[Si](Cl)(Cl)CCCc1ccccc1 196416938 YTZJIDYIVLNKAW-UHFFFAOYSA-N 233.214 4.169 70 40 BIIB Cc1cccc(-c2cc(-c3cccs3)n[nH]2)c1 216696572 VMSVYMDIWRSYSU-UHFFFAOYSA-N 240.331 4.114 70 40 BIIB CCc1ccc(-c2cc(-c3ccco3)on2)cc1 216698086 RCGZZKGZNKEBTR-UHFFFAOYSA-N 239.274 4.164 70 40 BIIB C[Si](Cl)(Cl)CC[C@H]1CC=CCC1 195766688 GIVCFIPFCVYUQZ-VIFPVBQESA-N 223.219 4.282 70 40 BIIB Cc1cccc(-c2cc(-c3cccs3)no2)c1 216666631 OFCJXOJVZMPGOT-UHFFFAOYSA-N 241.315 4.379 70 40 BIIB Cl[Si](Cl)(Cl)CC[C@@H]1CC=CCC1 195766785 BACYXSNZANMSGE-MRVPVSSYSA-N 243.637 4.388 70 40 BIIB CC(C)[Si](Cl)(CCCC#N)C(C)C 195755134 XUXDFYOAZJIKNI-UHFFFAOYSA-N 217.816 4.294 70 40 BIIB Cl[Si](Cl)(Cl)CC1CCCCC1 169811069 NAHQHOCDGCGAJH-UHFFFAOYSA-N 231.626 4.222 70 40 BIIB CC[Si](C)(Cl)C[C@H]1C[C@H]2C=C[C@H]1C2 201092577 NVCZXBYGFNJABR-HQFGAJJPSA-N 214.812 4.033 70 40 BIIB Cl[Si](Cl)(Cl)CC[C@H]1CC=CCC1 195766787 BACYXSNZANMSGE-QMMMGPOBSA-N 243.637 4.388 70 40 BIIB FC(F)c1cccc(OCc2ccccc2)c1 217073691 LHKJDVXQSLFAPS-UHFFFAOYSA-N 234.245 4.203 70 40 BIIB CC[C@@H](CC[SiH](C)C)c1ccccc1 195766548 XYEYZGZSYOUCIF-LBPRGKRZSA-N 206.405 4.057 70 40 BIIB