smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(Cc2cc3c(=O)n([C@H]4CCCC[C@@H]4O)cnc3c3ccccc23)c[nH+]1 ZINC000095930184 570407651 /nfs/dbraw/zinc/40/76/51/570407651.db2.gz JUVQLZBJFOGEEO-GOTSBHOMSA-N 1 2 399.494 4.320 10 5 investigational GIBELO CCCc1c[nH]c([C@@H]2Cc3ccccc3N2C(=O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC000013588014 206295038 /nfs/dbraw/zinc/29/50/38/206295038.db2.gz OIWGJZRYECFWDM-IBGZPJMESA-N 1 2 376.416 4.215 10 5 GIBELO CCCc1c[nH]c([C@H]2Cc3ccccc3N2C(=O)c2ccccc2[N+](=O)[O-])[nH+]1 ZINC000013588011 206295496 /nfs/dbraw/zinc/29/54/96/206295496.db2.gz OBVQLQNNURKQES-LJQANCHMSA-N 1 2 376.416 4.215 10 5 GIBELO Cc1[nH+]cc(NC(=O)c2ccc([N+](=O)[O-])o2)n1-c1nc(-c2ccccc2)cs1 ZINC000032642146 206256550 /nfs/dbraw/zinc/25/65/50/206256550.db2.gz KWXKDHYUYXPDQP-UHFFFAOYSA-N 1 2 395.400 4.058 10 5 GIBELO CCCc1c[nH]c([C@H]2Cc3ccccc3N2C(=O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC000013588015 206295198 /nfs/dbraw/zinc/29/51/98/206295198.db2.gz OIWGJZRYECFWDM-LJQANCHMSA-N 1 2 376.416 4.215 10 5 GIBELO CCCc1c[nH]c([C@@H]2Cc3ccccc3N2C(=O)c2ccccc2[N+](=O)[O-])[nH+]1 ZINC000013588010 212149885 /nfs/dbraw/zinc/14/98/85/212149885.db2.gz OBVQLQNNURKQES-IBGZPJMESA-N 1 2 376.416 4.215 10 5 GIBELO