General
Preferred name
VESTIPITANT
Synonyms
GW 597599 ()
Vestipitant mesylate ()
Gw597599 ()
GW-597599 ()
GW-597588B ()
GW597588B ()
Vestipitant mesilate ()
GW597599B ()
GW-597599B ()
P&D ID
PD048991
CAS
334476-46-9
334476-64-1
Tags
drug candidate
Drug indication
Major depressive disorder
Mood disorder
Drug Status
investigational
Max Phase
Phase 2
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
Vestipitant is an investigational NK1 receptor antagonist.
(GtoPdb)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
5
ChEMBL Drugs
DrugBank
DrugMAP
Guide to Pharmacology
LSP-MoA library (Laboratory of Systems Pharmacology)
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
29
Molecular Weight
491.18
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
3
Ring Count
3
Aromatic Ring Count
2
cLogP
5.93
TPSA
35.58
Fraction CSP3
0.43
Chiral centers
2.0
Largest ring
6.0
QED
0.54
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
