smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC(=O)Nc1cc2[nH]c3nc(=O)[nH]c(=O)c-3nc2cc1C ZINC000006818700 281953756 /nfs/dbraw/zinc/95/37/56/281953756.db2.gz SRGYFBVSGMFHQM-UHFFFAOYSA-N 0 2 299.290 0.817 1 5 CCBFLN