[3H]sumatriptan

Ligand id: 119

Name: [3H]sumatriptan    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 73.58
Molecular weight 295.14
XLogP 0.97
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-[3-[2-[bis(tritritiomethyl)amino]ethyl]-1H-indol-5-yl]-N-methylmethanesulfonamide
Database Links
ChEMBL Ligand CHEMBL1628680
PubChem CID 53325948
Search Google for chemical match using the InChIKey KQKPFRSPSRPDEB-KERYDJPLSA-N
Search Google for chemicals with the same backbone KQKPFRSPSRPDEB
Search UniChem for chemical match using the InChIKey KQKPFRSPSRPDEB-KERYDJPLSA-N
Search UniChem for chemicals with the same backbone KQKPFRSPSRPDEB