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@@H](c1ccc2ccc3cccc4ccc1c2c34)C(C(=O)[O-])C(=O)[O-] ZINC000002048572 564099371 /nfs/dbraw/zinc/09/93/71/564099371.db2.gz MHRXBOPGEVHNRK-NSHDSACASA-N -2 0 332.355 4.473 40 5 EIBBRL C[C@H](c1ccc2ccc3cccc4ccc1c2c34)C(C(=O)[O-])C(=O)[O-] ZINC000001661410 564098995 /nfs/dbraw/zinc/09/89/95/564098995.db2.gz MHRXBOPGEVHNRK-LLVKDONJSA-N -2 0 332.355 4.473 40 5 EIBBRL