smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCn1cc2c(n1)nc(NC(=O)Nc1ccc(S(=O)(=O)F)cc1)n1nc(-c3ccco3)nc21 ZINC000043300349 563169308 /nfs/dbraw/zinc/16/93/08/563169308.db2.gz XOLUPBLUZGIGNN-UHFFFAOYSA-N 0 0 484.473 3.446 1 70 JGIFRN CCn1cc2c(n1)nc(NC(=O)Nc1ccc(S(=O)(=O)F)cc1)n1nc(-c3ccco3)nc21 ZINC000043300236 563169197 /nfs/dbraw/zinc/16/91/97/563169197.db2.gz KMFFNBZQRKLUFF-UHFFFAOYSA-N 0 0 470.446 3.056 1 70 JGIFRN