General
Preferred name
Dihydroergotoxine
Synonyms
DIHYDROERGOTAMINE MESYLATE ()
P&D ID
PD041640
CAS
11032-41-0
6190-39-2
Tags
available
drug
Drug indication
Alzheimer disease
Drug Status
approved
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
The mesylate salt form of Dihydroergotamine, which has been found to be a partial α-adrenergic agonist and could be used as an antimigraine agent.
(BOC Sciences Bioactive Compounds)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
3
BOC Sciences Bioactive Compounds
DrugMAP
DrugMAP Approved Drugs
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
9
Molecular Weight
679.27
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
4
Rotatable Bonds
4
Ring Count
8
Aromatic Ring Count
3
cLogP
1.59
TPSA
172.58
Fraction CSP3
0.5
Chiral centers
7.0
Largest ring
6.0
QED
0.3
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Therapeutic Class
Vasodilator Agents
Source data
