smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [O-]c1ccccc1[C@@H]1CC(c2c3ccccc3cc3ccccc32)=NN1 ZINC000071316433 203090640 /nfs/dbraw/zinc/09/06/40/203090640.db2.gz JXDBUOPWCXRJKN-FQEVSTJZSA-N -1 3 338.410 5.137 1 10 EKCFHM O=C([O-])/C=C\c1cccc(Nc2c3ccccc3nc3ccccc32)c1 ZINC000111468615 204359553 /nfs/dbraw/zinc/35/95/53/204359553.db2.gz DBFNPQYMRDEKPT-SEYXRHQNSA-N -1 3 340.382 5.229 1 10 EKCFHM