smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC(C)(C)[Si](F)(CCNC(=O)Cc1ccccc1)C(C)(C)C 210632544 CVQVFGMCNZQKPM-UHFFFAOYSA-N 323.528 4.861 70 1 DJIF CC(C)(C)[Si](F)(CC(=O)NCc1ccccc1)C(C)(C)C 210624446 JPUFTHKHPUKQAG-UHFFFAOYSA-N 309.501 4.818 70 1 DJIF Cc1ccc([C@H](CNC(=O)c2cccc(C)c2C)CC(C)C)cn1 217359340 CMTFEFLWJDIJOG-IBGZPJMESA-N 324.468 4.567 70 1 DJIF CC(C)c1cccn2c(C3(c4ccc(Cl)cc4)CC3)nnc12 218258235 TVFMGTKSNWTWKN-UHFFFAOYSA-N 311.816 4.586 70 1 DJIF CC(C)/C=C\c1cc2cc(-c3cc(O)cc(O)c3)oc2cc1O 216873364 KMSIOVRZJTULCD-ARJAWSKDSA-N 310.349 4.886 70 1 DJIF Cc1[nH]c(-c2ccccc2Oc2ccccc2)c2cc[nH]c(=O)c12 218368781 ZVBYYZLLHHAMEC-UHFFFAOYSA-N 316.360 4.624 70 1 DJIF Cc1ccc([C@@H](CNC(=O)c2cccc(C)c2C)CC(C)C)cn1 217359258 CMTFEFLWJDIJOG-LJQANCHMSA-N 324.468 4.567 70 1 DJIF