α-ergocryptine

Ligand id: 271

Name: α-ergocryptine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 118.21
Molecular weight 575.31
XLogP 2.67
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
Database Links
CAS Registry No. 511-09-1 (source: NCI)
ChEBI CHEBI:10276
ChEMBL Ligand CHEMBL1403281
PubChem CID 134551
Search Google for chemical match using the InChIKey YDOTUXAWKBPQJW-NSLWYYNWSA-N
Search Google for chemicals with the same backbone YDOTUXAWKBPQJW
Search UniChem for chemical match using the InChIKey YDOTUXAWKBPQJW-NSLWYYNWSA-N
Search UniChem for chemicals with the same backbone YDOTUXAWKBPQJW
Wikipedia Ergocryptine