smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(NN1C(=O)/C(=C/c2ccc(-c3ccccc3)o2)SC1=S)c1cccs1 ZINC000001411662 557259350 /nfs/dbraw/zinc/25/93/50/557259350.db2.gz AZFHWLRNWSXQIX-WJDWOHSUSA-N 0 1 412.517 4.554 10 10 HJCEMN O=C1NC(=S)N(c2ccc(Cl)cc2)C(=O)C1=Cc1cccn1-c1ccccc1 ZINC000001173986 132240228 /nfs/dbraw/zinc/24/02/28/132240228.db2.gz BZZRYPZQNODVPD-AQTBWJFISA-N 0 1 407.882 4.802 10 10 HJCEMN