smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)c1ccc(C[N@@H+]2CCC[C@@H](c3ccnc(SCC[NH+]4CCCC4)n3)C2)cc1 ZINC000011967015 556677427 /nfs/dbraw/zinc/67/74/27/556677427.db2.gz ZJCZDCGQYLFGFF-OAQYLSRUSA-N 2 0 425.646 4.110 10 10 IICERP CN(C)c1ccc(C[N@@H+]2CCC[C@H](c3ccnc(SCC[NH+]4CCCC4)n3)C2)cc1 ZINC000011967025 556677352 /nfs/dbraw/zinc/67/73/52/556677352.db2.gz ZJCZDCGQYLFGFF-NRFANRHFSA-N 2 0 425.646 4.110 10 10 IICERP