smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])C(C(=O)O)[C@H](Cc1ccccc1)c1ccc(-c2ccccc2)cc1 ZINC000006096607 204237684 /nfs/dbraw/zinc/23/76/84/204237684.db2.gz QUFVZWVTYPOLSK-HXUWFJFHSA-N -1 2 360.409 4.465 10 0 FIAELM