General
Preferred name
Isometheptene mucate
Synonyms
Midrid ()
Octin mucate ()
P&D ID
PD077726
Tags
drug candidate
Drug indication
migraine disorder
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
1
ChEMBL Drugs
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
7
Properties
(calculated by RDKit )
Molecular Weight
492.34
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
8
Rotatable Bonds
13
Ring Count
0
Aromatic Ring Count
0
cLogP
1.28
TPSA
179.58
Fraction CSP3
0.75
Chiral centers
6.0
Largest ring
0.0
QED
0.17
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
