[3H]mesulergine

Ligand id: 232

Name: [3H]mesulergine    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 53.93
Molecular weight 361.18
XLogP 2.1
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-{6,11-dimethyl-6,11-diazatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(16),9,12,14-tetraen-4-yl}-N,N-dimethylmethanesulfonamide
Database Links
PubChem CID 4081
Search Google for chemical match using the InChIKey WYCMFCPHWDZHMR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone WYCMFCPHWDZHMR
Search UniChem for chemical match using the InChIKey WYCMFCPHWDZHMR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WYCMFCPHWDZHMR
Wikipedia Mesulergine