smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1C(=O)C(c2ccccc2)C(=O)C([O-])=C1c1ccc(O)cc1 ZINC000042851443 183314187 /nfs/dbraw/zinc/31/41/87/183314187.db2.gz PNTORJXTFRBTDZ-UHFFFAOYSA-N -1 2 308.289 2.782 1 30 DFEFLM O=C([O-])C(=O)C=C(O)c1cccc(Cc2cccc(F)c2)c1 ZINC000005974017 181302665 /nfs/dbraw/zinc/30/26/65/181302665.db2.gz QEQBDJOPQAFQSS-GDNBJRDFSA-N -1 2 300.285 2.969 1 30 DFEFLM O=C([O-])C(=O)C=C(O)c1ccccc1Cc1ccc(F)cc1 ZINC000101029460 193807698 /nfs/dbraw/zinc/80/76/98/193807698.db2.gz PTIVWHWNMNZVMT-GDNBJRDFSA-N -1 2 300.285 2.969 1 30 DFEFLM O=C([O-])C(=O)C=C(O)c1cccc(Cc2ccccc2F)c1 ZINC000005974371 181303027 /nfs/dbraw/zinc/30/30/27/181303027.db2.gz BXXLOISPRMUOPQ-GDNBJRDFSA-N -1 2 300.285 2.969 1 30 DFEFLM