smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)N(CC(=O)c1ccc2cc(Cl)c3ccccc3c2c1)C(C)C ZINC000001676205 570504475 /nfs/dbraw/zinc/50/44/75/570504475.db2.gz VQPFZENULFYSJS-UHFFFAOYSA-N 0 1 353.893 5.948 40 5 FKBBMN O=C(CN1CCCCC1)Nc1cc2c3ccccc3ccc2c2ccccc12 ZINC000001726383 210367165 /nfs/dbraw/zinc/36/71/65/210367165.db2.gz RIHRDOQCULCXCI-UHFFFAOYSA-N 0 1 368.480 5.571 40 5 FKBBMN c1ccc2sc(NN=c3c4ccccc4sc4ccccc43)nc2c1 ZINC000008637741 207241021 /nfs/dbraw/zinc/24/10/21/207241021.db2.gz VFRZHUYFEMIAFP-UHFFFAOYSA-N 0 1 359.479 5.592 40 5 FKBBMN O=[N+]([O-])c1ccc(O)c(/C=C/c2ccc3oc(-c4ccccc4)nc3c2)c1 ZINC000034903288 208113186 /nfs/dbraw/zinc/11/31/86/208113186.db2.gz XPXXEWJNTJGXHS-SOFGYWHQSA-N 0 1 358.353 5.279 40 5 FKBBMN