smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCc1ccc(C2C(=O)C(=O)C(c3ccccc3)=C([O-])C2=O)cc1 ZINC000001689492 563291184 /nfs/dbraw/zinc/29/11/84/563291184.db2.gz LNOKZIKOAIKCOG-UHFFFAOYSA-N -1 2 320.344 3.639 40 30 DHEBLM CC(=[NH+]Nc1nnc(SCCC(C)C)[n-]1)c1ccccc1 ZINC000009695146 563353829 /nfs/dbraw/zinc/35/38/29/563353829.db2.gz RENHFDYZRCIOLF-SFQUDFHCSA-N -1 2 303.435 3.779 40 30 DHEBLM