smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccn2c(c1)nc(-c1ccc(Cl)cc1)c2/C=C/C(=O)[O-] ZINC000002599594 180938816 /nfs/dbraw/zinc/93/88/16/180938816.db2.gz JGYPFQPHSNKOMO-VOTSOKGWSA-N -1 0 312.756 4.061 30 0 DIACRM Cc1cccn2c(/C=C/C(=O)[O-])c(-c3ccc(Cl)cc3)nc12 ZINC000002599602 563914048 /nfs/dbraw/zinc/91/40/48/563914048.db2.gz XHTGKZPNKXGKPV-CMDGGOBGSA-N -1 0 312.756 4.061 30 0 DIACRM