smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(OC[C@@H](C)NC(=O)c2ccc([N-]S(C)(=O)=O)cc2)cc1 ZINC000218401908 525430031 /nfs/dbraw/zinc/43/00/31/525430031.db2.gz LMNNTBKFEUBXJO-CQSZACIVSA-N -1 3 362.451 2.564 40 70 FFIBHM Cc1ccc(OC[C@H](C)NC(=O)c2ccc([N-]S(C)(=O)=O)cc2)cc1 ZINC000218401993 525436381 /nfs/dbraw/zinc/43/63/81/525436381.db2.gz LMNNTBKFEUBXJO-AWEZNQCLSA-N -1 3 362.451 2.564 40 70 FFIBHM