smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1CCN(Cc2ccc(C(=O)NCc3nnc(-c4ccccc4)[nH]3)o2)CC1 ZINC000217805117 570321729 /nfs/dbraw/zinc/32/17/29/570321729.db2.gz SGYRDLICTNJGGN-UHFFFAOYSA-N 0 3 379.464 3.227 50 70 GGIAHN Cc1nnc([C@H](C)NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)[nH]1 ZINC000217022689 570311544 /nfs/dbraw/zinc/31/15/44/570311544.db2.gz LHTKKYQOFQJXHQ-HNNXBMFYSA-N 0 3 375.476 3.162 50 70 GGIAHN Cc1nnc([C@@H](C)NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)[nH]1 ZINC000217022651 570311470 /nfs/dbraw/zinc/31/14/70/570311470.db2.gz LHTKKYQOFQJXHQ-OAHLLOKOSA-N 0 3 375.476 3.162 50 70 GGIAHN CN(CCc1nc2cc(F)ccc2[nH]1)C(=O)[C@@H]1CCCN1Cc1ccccc1 ZINC000218750043 570340310 /nfs/dbraw/zinc/34/03/10/570340310.db2.gz FLSASQPCFCEADX-FQEVSTJZSA-N 0 3 380.467 3.368 50 70 GGIAHN