smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C=CCN(c1ccccc1Cl)S(=O)(=O)c1cccc(C(=O)Nc2nc(-c3cccs3)n[nH]2)c1 ZINC000917127382 1066483974 /nfs/dbraw/zinc/48/39/74/1066483974.db2.gz GHMKDHTWFUEKAD-UHFFFAOYSA-N 0 1 500.005 4.820 20 30 KJEDMN C=CCN(c1ccccc1)S(=O)(=O)c1cc(C(=O)Nc2nc(-c3cccs3)n[nH]2)ccc1Cl ZINC000917128159 1066484036 /nfs/dbraw/zinc/48/40/36/1066484036.db2.gz UBQYQBOMPKECGL-UHFFFAOYSA-N 0 1 500.005 4.820 20 30 KJEDMN