smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(C(=O)F)cc1 39270912 1386476161 /nfs/dbraw/zinc/47/61/61/1386476161.db2.gz OPPZXSHNADAQES-UHFFFAOYSA-N 0 0 138.141 2.105 40 50 AEGBRN C/C(C=O)=C\c1cccc(C)c1O 218716868 166055645 /nfs/dbraw/zinc/05/56/45/166055645.db2.gz KRTKFTQGZBGYLL-SOFGYWHQSA-N 0 0 176.215 2.303 40 50 AEGBRN