smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)S(=O)(=O)N1CC[N@H+](C)[C@H](c2ccccc2)C1 ZINC000216871406 397433536 /nfs/dbraw/zinc/43/35/36/397433536.db2.gz NETBFVDUJWWESV-ZDUSSCGKSA-N 1 2 283.397 0.782 40 70 CCIBLO CN(C)S(=O)(=O)N1CC[N@@H+](C)[C@H](c2ccccc2)C1 ZINC000216871406 397433538 /nfs/dbraw/zinc/43/35/38/397433538.db2.gz NETBFVDUJWWESV-ZDUSSCGKSA-N 1 2 283.397 0.782 40 70 CCIBLO Cc1ccc(C(N)=O)cc1S(=O)(=O)N1CC[NH+](C)CC1 ZINC000216853235 262341194 /nfs/dbraw/zinc/34/11/94/262341194.db2.gz NYJFNEBRZQSZTC-UHFFFAOYSA-N 1 2 297.380 0.030 40 70 CCIBLO