General
Preferred name
DOTARIZINE
Synonyms
P&D ID
PD077534
CAS
84625-59-2
Tags
available
drug candidate
Drug indication
Migraine
Drug Status
investigational
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
4
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
15
Properties
(calculated by RDKit )
Molecular Weight
442.26
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
8
Ring Count
5
Aromatic Ring Count
3
cLogP
5.07
TPSA
24.94
Fraction CSP3
0.38
Chiral centers
0.0
Largest ring
6.0
QED
0.49
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
