smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cl[Si](Cl)(Cl)CCC12CC3CC(CC(C3)C1)C2 195761925 HLBWWITUVOEXHH-UHFFFAOYSA-N 297.729 5.248 70 40 CKIB Cc1ccsc1-c1cc(-c2ccc(Cl)cc2)no1 216666437 VHVCGLBCKKQOJT-UHFFFAOYSA-N 275.760 5.032 70 40 CKIB CC(C)(C)c1ccc(-c2cc(-c3cccs3)on2)cc1 216697398 BCFNMKDCHXAXAS-UHFFFAOYSA-N 283.396 5.368 70 40 CKIB CCCCCSB(SCCCCC)c1ccccc1 195763407 LTFWQDMESBUABS-UHFFFAOYSA-N 294.338 5.229 70 40 CKIB Cc1ccc2ccccc2c1C(=O)C[C@H](C)CC(C)(C)C 160822345 AVMNBIBFFLGEKS-AWEZNQCLSA-N 282.427 5.793 70 40 CKIB Cc1ccc2ccccc2c1C(=O)C[C@@H](C)CC(C)(C)C 160822215 AVMNBIBFFLGEKS-CQSZACIVSA-N 282.427 5.793 70 40 CKIB Cc1ccc(-c2cc(-c3cc4ccccc4o3)on2)cc1 216698359 KCYHLPFPNLGXPS-UHFFFAOYSA-N 275.307 5.063 70 40 CKIB CCCN(Cc1ccccc1)[C@H](C)c1ccc(C)c(NC)c1 218321672 WNVGSQTUIJWVAA-QGZVFWFLSA-N 296.458 5.010 70 40 CKIB Cc1ccccc1Nc1c(C)c(C)nc2c(C)cccc12 217442966 KIAAMVIVXYFHLH-UHFFFAOYSA-N 276.383 5.212 70 40 CKIB CCCN(Cc1ccccc1)[C@@H](C)c1ccc(C)c(NC)c1 218321555 WNVGSQTUIJWVAA-KRWDZBQOSA-N 296.458 5.010 70 40 CKIB CCCCCCCCCCCCCCCCCC[SiH2] 604938068 AQBQBCSFOUWPAP-UHFFFAOYSA-N 283.596 6.299 70 40 CKIB ClCc1ccc(N=C=Nc2ccc(CCl)cc2)cc1 100497007 XNNHFQRXVPPGRU-UHFFFAOYSA-N 291.181 5.301 70 40 CKIB CCCNc1cc([C@@H](C)N(C)Cc2ccccc2)ccc1C 218319541 XADYFRQWMUHQAQ-QGZVFWFLSA-N 296.458 5.010 70 40 CKIB [N-]=[N+]=NC(=O)c1cc2ccc3ccccc3c2c2ccccc12 17014749 DHJRYYPXGVCHEX-UHFFFAOYSA-N 297.317 5.597 70 40 CKIB c1ccc([C@@H]2c3ccccc3O[C@]3(c4ccccc4)C[C@@H]23)cc1 217447865 JUFPLNWTZDOHHG-NNWRFLSQSA-N 298.385 5.126 70 40 CKIB CC(C)c1ccc(-c2cc(-c3cccs3)on2)cc1 216697534 ZNGWOLUOBXGNJB-UHFFFAOYSA-N 269.369 5.194 70 40 CKIB CC(C)(C)c1ccc(CC[Si](Cl)(Cl)Cl)cc1 196325367 QWNMCEZWNSHQMT-UHFFFAOYSA-N 295.713 5.182 70 40 CKIB CCNc1cc([C@H](C)N(CC)Cc2ccccc2)ccc1C 218320551 PCTKOQVYSXFABG-KRWDZBQOSA-N 296.458 5.010 70 40 CKIB CCCCCCCCCCC[Si](Cl)(Cl)Cl 196831832 AHEMBBKAVCEZKE-UHFFFAOYSA-N 289.750 6.173 70 40 CKIB CCCCCc1c(C)[nH]c2c(C)cccc2c1=S 217443811 NZGQXKIGPWVFKR-UHFFFAOYSA-N 259.418 5.247 70 40 CKIB CCCCCCc1c(C)[nH]c2ccccc2c1=S 217442869 RKENEJKJIHXHAX-UHFFFAOYSA-N 259.418 5.329 70 40 CKIB Cc1ccc([C@H](C)N(C)Cc2ccccc2)cc1NC(C)C 218319443 DRCKSXGJLQYKNR-KRWDZBQOSA-N 296.458 5.008 70 40 CKIB C[Si](C)(Cl)CCCCCCc1ccccc1 198532495 YIKNKAIDGMTIMI-UHFFFAOYSA-N 254.877 5.233 70 40 CKIB Cc1ccc([C@@H](C)N(C)Cc2ccccc2)cc1NC(C)C 218319361 DRCKSXGJLQYKNR-QGZVFWFLSA-N 296.458 5.008 70 40 CKIB Cc1cc(C)c(N=C=Nc2c(C)cc(C)cc2C)c(C)c1 8927036 QIFLGIYKGHMJPY-UHFFFAOYSA-N 278.399 5.674 70 40 CKIB C[Si](C)(Cl)CCCCCCCC[Si](C)(C)Cl 195764751 QRGNIFCMKCRMQY-UHFFFAOYSA-N 299.434 6.215 70 40 CKIB CCCNc1cc([C@H](C)N(C)Cc2ccccc2)ccc1C 218319639 XADYFRQWMUHQAQ-KRWDZBQOSA-N 296.458 5.010 70 40 CKIB Cc1[nH]c2c(C)cccc2c(=S)c1Cc1ccccc1 217443934 QGIOUDYJNLTUHC-UHFFFAOYSA-N 279.408 5.105 70 40 CKIB Cc1ccc2ccccc2c1C(=O)CCC1CCCC1 160821665 KRNSSHONTPKBIW-UHFFFAOYSA-N 266.384 5.301 70 40 CKIB COC(=O)CCCCCCCCCC[Si](C)(C)Cl 195754875 ZTVPSFFFPDOOLA-UHFFFAOYSA-N 292.923 5.114 70 40 CKIB CCCCCCCCCC[Si](C)(Cl)Cl 195767058 UFVFNJHZBMHRCO-UHFFFAOYSA-N 255.305 5.677 70 40 CKIB CN(C)c1ccc(N=C=NC2CCCCC2)c2ccccc12 14983333 HAVINNWJVRVGNR-UHFFFAOYSA-N 293.414 5.044 70 40 CKIB C[Si](C)(Cl)CCCCCC[Si](C)(C)Cl 169747814 SEEQROYMPAMQOF-UHFFFAOYSA-N 271.380 5.435 70 40 CKIB C[C@H]1[C@H](B[C@@H]2C[C@@H]3C[C@H]([C@H]2C)C3(C)C)C[C@@H]2C[C@H]1C2(C)C 169989648 KBGJOMVTAXYPAG-VMAIWCPRSA-N 286.312 5.404 70 40 CKIB CCNc1cc([C@@H](C)N(CC)Cc2ccccc2)ccc1C 218320445 PCTKOQVYSXFABG-QGZVFWFLSA-N 296.458 5.010 70 40 CKIB CCc1ccc(-c2cc(-c3cc4ccccc4o3)on2)cc1 216698827 LYRPQRNMNZXSQD-UHFFFAOYSA-N 289.334 5.317 70 40 CKIB