smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)CCNC(=O)n1c(C(=O)[O-])nc(=O)n1-c1ccccc1 ZINC000036533598 374475742 /nfs/dbraw/zinc/47/57/42/374475742.db2.gz GWAWQFOZHSNDAR-UHFFFAOYSA-N -1 3 319.321 -0.149 30 0 DBACHM