smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccccc1C(N)=O ZINC000218395116 278114860 /nfs/dbraw/zinc/11/48/60/278114860.db2.gz LFNLUPFAKMRPFR-UHFFFAOYSA-N -1 0 333.369 1.409 40 70 EDIBRM