Ligand Id: 133
Ligand name metergoline

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 46.5
Molecular weight 403.23
XLogP 5.3
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Summary Biological activity References Structure Similar ligands Suppliers
Classification
Compound class Synthetic organic
International Nonproprietary Names
INN number INN
2378 metergoline
Synonyms
1,6-Dimethyl-8-beta-carbobenzyloxaminomethyl-10-alpha-ergoline
(((8-beta)-1,6-Dimethylergolin-8-yl)methyl)carbamic acid phenylmethyl ester
Liserdol
Metergoline phenylmethyl ester
Database Links
CAS Registry No. 17692-51-2 (source: Scifinder)
ChEMBL Ligand 121938
PubChem CID 4090
Search Google for chemical match using the InChIKey WZHJKEUHNJHDLS-QTGUNEKASA-N
Search Google for chemicals with the same backbone WZHJKEUHNJHDLS
Search PubMed clinical trials metergoline
Search PubMed titles metergoline
Search PubMed titles/abstracts metergoline
Wikipedia Metergoline
ZINC ZINC03873781, ZINC03812975, ZINC03873778, ZINC03873780

Contact us | Print | Back to top | Help