smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(N)CCCC1 ZINC000096937349 185393122 /nfs/dbraw/zinc/39/31/22/185393122.db2.gz ARPLKCSGNIAIRJ-NSHDSACASA-N 0 3 322.361 0.570 1 10 DCCFHN