smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(/C=C/C(=O)NCc2ccccc2-n2cc[nH+]c2)cc1OC ZINC000161418006 206228431 /nfs/dbraw/zinc/22/84/31/206228431.db2.gz PVECUKCONMRTMS-CSKARUKUSA-N 1 2 363.417 3.219 40 70 FGIBLO Cc1nc2n(n1)C(=O)C([C@@H](c1cccn1C)[N@H+](C)Cc1ccccc1)S2 ZINC000218499148 497003989 /nfs/dbraw/zinc/00/39/89/497003989.db2.gz CWULJNKWYMQFOV-MRXNPFEDSA-N 1 2 367.478 3.365 40 70 FGIBLO Cc1nc2n(n1)C(=O)C([C@@H](c1cccn1C)[N@@H+](C)Cc1ccccc1)S2 ZINC000218499148 497003992 /nfs/dbraw/zinc/00/39/92/497003992.db2.gz CWULJNKWYMQFOV-MRXNPFEDSA-N 1 2 367.478 3.365 40 70 FGIBLO Cc1nc2n(n1)C(=O)C([C@H](c1cccn1C)[N@H+](C)Cc1ccccc1)S2 ZINC000218499229 497003544 /nfs/dbraw/zinc/00/35/44/497003544.db2.gz CWULJNKWYMQFOV-INIZCTEOSA-N 1 2 367.478 3.365 40 70 FGIBLO Cc1nc2n(n1)C(=O)C([C@H](c1cccn1C)[N@@H+](C)Cc1ccccc1)S2 ZINC000218499229 497003552 /nfs/dbraw/zinc/00/35/52/497003552.db2.gz CWULJNKWYMQFOV-INIZCTEOSA-N 1 2 367.478 3.365 40 70 FGIBLO