smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C#Cc1cn(CC=C2OC(=O)C(O)=C2O)c(=O)[nH]c1=O ZINC000028643150 171568497 /nfs/dbraw/zinc/56/84/97/171568497.db2.gz HEZZUCUJQNMRSL-CLTKARDFSA-N 0 2 276.204 -0.714 1 30 CBEFLN OC(O)(C(F)F)C(F)(F)C(O)(O)C(F)(F)F ZINC000139982797 351924642 /nfs/dbraw/zinc/92/46/42/351924642.db2.gz NFXARNCSAQXFHD-UHFFFAOYSA-N 0 2 262.077 -0.189 2 30 CBEFLN