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([O-])CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O ZINC000037433647 597027804 /nfs/dbraw/zinc/02/78/04/597027804.db2.gz MFKDKMPCSZKFMR-UHFFFAOYSA-N -2 0 241.159 -0.903 20 5 BBBDRL Cc1noc(=NC(=O)c2cc([N+](=O)[O-])n[nH]2)[n-]1 ZINC000350720157 355748125 /nfs/dbraw/zinc/74/81/25/355748125.db2.gz NNSCCTWSXBOFMR-UHFFFAOYSA-N -2 0 238.163 -0.316 20 5 BBBDRL