smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Fc1ccc(CN2CC=C(c3nc4ccccc4o3)CC2)cc1 ZINC000216784709 563851914 /nfs/dbraw/zinc/85/19/14/563851914.db2.gz GTZKLFLKQWWCMR-UHFFFAOYSA-N 0 1 308.356 4.256 40 70 DIIBMN Fc1cccc(CN2CC=C(c3nc4ccccc4o3)CC2)c1 ZINC000216785204 563852180 /nfs/dbraw/zinc/85/21/80/563852180.db2.gz LKTBKMBACDVIEC-UHFFFAOYSA-N 0 1 308.356 4.256 40 70 DIIBMN