smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=P([O-])([O-])[C@@H](Cc1ccc(Cl)cc1)c1cccc2ccccc21 ZINC000029475506 202187967 /nfs/dbraw/zinc/18/79/67/202187967.db2.gz MFRGSBVJDFOSTN-SFHVURJKSA-N -2 3 346.750 4.955 1 0 EJAFHL O=c1cc(-c2ccccc2)oc2c(-c3ccsc3)c([O-])cc([O-])c12 ZINC000072118048 216012318 /nfs/dbraw/zinc/01/23/18/216012318.db2.gz ZEZIXFVHGXCDIR-UHFFFAOYSA-N -2 3 336.368 4.600 1 0 EJAFHL