smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCc1cc(=O)[nH]c(C[N@@H+](C)Cc2ccc(O)c(OC)c2)n1 ZINC000160726901 402358513 /nfs/dbraw/zinc/35/85/13/402358513.db2.gz LNRWCLRYZZSVMH-UHFFFAOYSA-N -1 2 303.362 2.091 20 70 DEIDLM COc1ccsc1S(=O)(=O)[N-]c1ccc2n[nH]cc2c1 ZINC000159723745 186137540 /nfs/dbraw/zinc/13/75/40/186137540.db2.gz QYRACPFKUYJOGW-UHFFFAOYSA-N -1 2 309.372 2.434 20 70 DEIDLM