smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COCCS(=O)(=O)Nc1cc([N+](=O)[O-])ccc1C(=O)[O-] ZINC000062823952 395973544 /nfs/dbraw/zinc/97/35/44/395973544.db2.gz ZCHJSKBFFXFFQQ-UHFFFAOYSA-N -1 2 304.280 0.681 10 5 DCBELM Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(=O)[O-])c2cc1C ZINC000003650711 415129060 /nfs/dbraw/zinc/12/90/60/415129060.db2.gz KDXDAXTZMKMJOW-UHFFFAOYSA-N -1 2 300.274 0.286 10 5 DCBELM