smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@](O)(CC(=O)[O-])Cc1ccc2c(c1[O-])C(=O)c1cccc([O-])c1C2=O ZINC000004654767 560199204 /nfs/dbraw/zinc/19/92/04/560199204.db2.gz MVEDBMGRQONWSQ-LJQANCHMSA-N -3 3 356.330 1.641 10 10 in-vitro FDCEHL C[C@](O)(CC(=O)[O-])Cc1ccc2c(c1[O-])C(=O)c1cccc(O)c1C2=O ZINC000004654767 560199206 /nfs/dbraw/zinc/19/92/06/560199206.db2.gz MVEDBMGRQONWSQ-LJQANCHMSA-N -2 3 356.330 1.641 10 10 in-vitro FDCEHL