sapropterin

Ligand id: 5276

Name: sapropterin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 6
Rotatable bonds 2
Topological polar surface area 119.64
Molecular weight 241.12
XLogP -1.18
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
Approved drug? Yes (FDA (2007), EMA (2008))
IUPAC Name
(6R)-2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-3,4,5,6,7,8-hexahydropteridin-4-one
International Nonproprietary Names
INN number INN
6553 sapropterin
Synonyms
Kuvan® | sapropterin dihydrochloride | SUN-0588 | T-1401 | tetrahydrobiopterin (THB)
Database Links
CAS Registry No. 17528-72-2
ChEBI CHEBI:59560
ChEMBL Ligand CHEMBL1201774
DrugBank Ligand DB00360
GtoPdb PubChem SID 178101959
PubChem CID 44257
RCSB PDB Ligand H4B
Search Google for chemical match using the InChIKey FNKQXYHWGSIFBK-RPDRRWSUSA-N
Search Google for chemicals with the same backbone FNKQXYHWGSIFBK
Search PubMed clinical trials sapropterin
Search PubMed titles sapropterin
Search PubMed titles/abstracts sapropterin
Search UniChem for chemical match using the InChIKey FNKQXYHWGSIFBK-RPDRRWSUSA-N
Search UniChem for chemicals with the same backbone FNKQXYHWGSIFBK
SynPHARM 79537 (in complex with L-Phenylalanine hydroxylase )
Wikipedia Tetrahydrobiopterin
Comments
A synthetic form of the essential enzymatic cofactor tetrahydrobiopterin (BH4). BH4 is a cofactor for tryptophan hydroxylase, phenylalanine hydroxylase, tyrosine hydroxylase, nitric oxide synthase and alkylglycerol monooxygenase.