smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(c1cc(-c2ccsc2)[nH]n1)N1C[C@H]2C[C@@H](C1)Cn1c(=O)cccc12 ZINC000218103858 509274778 /nfs/dbraw/zinc/27/47/78/509274778.db2.gz HYJDMVKIARCMPU-GXTWGEPZSA-N 0 1 366.446 2.559 40 70 FFIBMN Cc1ccc(CS(=O)(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000216947947 524639691 /nfs/dbraw/zinc/63/96/91/524639691.db2.gz QWPCNGXPUDGEJT-UHFFFAOYSA-N 0 1 359.495 2.689 40 70 FFIBMN