sulfaphenazole   Click here for help

GtoPdb Ligand ID: 11352

Synonyms: Sulfabid®
Compound class: Synthetic organic
Comment: Sulfaphenazole is a long-acting sulfonamide antibacterial.
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 97.87
Molecular weight 314.08
XLogP 2.53
No. Lipinski's rules broken 0
Click here for help
Canonical SMILES Nc1ccc(cc1)S(=O)(=O)Nc1ccnn1c1ccccc1
Isomeric SMILES Nc1ccc(cc1)S(=O)(=O)Nc1ccnn1c1ccccc1
InChI InChI=1S/C15H14N4O2S/c16-12-6-8-14(9-7-12)22(20,21)18-15-10-11-17-19(15)13-4-2-1-3-5-13/h1-11,18H,16H2
1. Bourrié M, Meunier V, Berger Y, Fabre G. (1996)
Cytochrome P450 isoform inhibitors as a tool for the investigation of metabolic reactions catalyzed by human liver microsomes.
J Pharmacol Exp Ther, 277 (1): 321-32. [PMID:8613937]
2. Miners JO, Smith KJ, Robson RA, McManus ME, Veronese ME, Birkett DJ. (1988)
Tolbutamide hydroxylation by human liver microsomes. Kinetic characterisation and relationship to other cytochrome P-450 dependent xenobiotic oxidations.
Biochem Pharmacol, 37 (6): 1137-44. [PMID:3355588]