smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCC(O)(P(=O)([O-])OC)[P@@](=O)([O-])OC ZINC000003171775 425610408 /nfs/dbraw/zinc/61/04/08/425610408.db2.gz DSVQMAJWURZYMH-UHFFFAOYSA-N -2 0 318.243 2.657 30 30 DFECRL COc1ccc(C=NNc2cc(C(=O)[O-])cc(C(=O)[O-])c2)cc1 ZINC000198006955 542865924 /nfs/dbraw/zinc/86/59/24/542865924.db2.gz XWPYIRQZJFMGGF-RQZCQDPDSA-N -2 0 314.297 2.538 30 30 DFECRL