(+)-SKF-82526

Ligand Id: 933
Ligand name (+)-SKF-82526

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 4
Rotatable bonds 1
Topological polar surface area 72.72
Molecular weight 305.08
XLogP 2.08
No. Lipinski's rules broken 0

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
IUPAC Name
(1S)-6-chloro-1-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol
International Nonproprietary Names
INN number INN
4673 fenoldopam
Database Links
CAS Registry No. 67227-57-0 (source: DrugBank)
ChEMBL Ligand CHEMBL1161520
DrugBank Ligand DB00800
PharmGKB Drug PA449596, PA164784034
PubChem CID 6603851
Search Google for chemical match using the InChIKey TVURRHSHRRELCG-ZDUSSCGKSA-N
Search Google for chemicals with the same backbone TVURRHSHRRELCG
Search PubMed clinical trials fenoldopam
Search PubMed titles fenoldopam
Search PubMed titles/abstracts fenoldopam
Wikipedia Fenoldopam
ZINC ZINC22116608
Comments
This isomer is component of the approved drug Fenoldopam, which is used to treat severe hypertension. (+)-SKF-82526 is the more active isomer. See our ligand entry for fenoldopam (Ligand ID 939) for more details.