smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name N#Cc1ccc(Cl)c(S(=O)(=O)[N-]C2(C#N)CCCCC2)c1 ZINC000160703506 268099178 /nfs/dbraw/zinc/09/91/78/268099178.db2.gz XLPONDHZWSSYRB-UHFFFAOYSA-N -1 3 323.805 2.716 10 70 DFIEHM C#CCNCc1cc(Br)c([O-])c(Br)c1 ZINC000218398837 398345810 /nfs/dbraw/zinc/34/58/10/398345810.db2.gz ZEEHINPKVDHIDE-UHFFFAOYSA-N -1 3 318.996 2.640 10 70 DFIEHM