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](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCc2cccc(O)c2C1 ZINC001160873175 793580027 /nfs/dbraw/zinc/58/00/27/793580027.db2.gz UHDDUSKQUGWCGU-CABZTGNLSA-N 0 3 334.376 -1.016 20 10 EACDHN