smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC[C@H](C(=O)N(C)Cc1nc(=O)c2sccc2[n-]1)N(C)C ZINC000161447572 408603130 /nfs/dbraw/zinc/60/31/30/408603130.db2.gz IWOSEKNWKWEBRI-LLVKDONJSA-N -1 0 322.434 1.673 10 70 DDIERM CCC[C@@H](C(=O)N(C)Cc1nc(=O)c2sccc2[n-]1)N(C)C ZINC000161447438 408602951 /nfs/dbraw/zinc/60/29/51/408602951.db2.gz IWOSEKNWKWEBRI-NSHDSACASA-N -1 0 322.434 1.673 10 70 DDIERM