General
Preferred name
Dihydro-alpha-ergocryptine
Synonyms
DIHYDROERGOCRYPTINE ()
ERGOLOID MESYLATES ()
DIHYDROERGOCRYPTINE MESYLATE ()
Alpha-Dihydroergocriptine ()
Dihydroergocryptine mesilate ()
P&D ID
PD013563
CAS
8067-24-1
29261-93-6
14271-05-7
25447-66-9
Tags
drug candidate
natural product
drug
available
Approved by
FDA
Drug Status
approved
Drug indication
Discovery agent
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()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
7
ChEMBL Drugs
DrugBank
DrugBank Approved Drugs
DrugCentral
DrugCentral Approved Drugs
DrugMAP
NPC Screening Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
38
Properties
(calculated by RDKit )
Molecular Weight
577.33
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
3
Rotatable Bonds
5
Ring Count
7
Aromatic Ring Count
2
cLogP
2.52
TPSA
118.21
Fraction CSP3
0.66
Chiral centers
7.0
Largest ring
6.0
QED
0.5
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
MOA
GABA Receptor
Pathway
Membrane Transporter/Ion Channel
Neuroscience
Source data
