General
Preferred name
BQ-123
Synonyms
BQ 123 ()
BQ123 ()
BQ-123 ()
P&D ID
PD021529
CAS
136553-81-6
Tags
drug candidate
natural product
available
Drug indication
Pulmonary arterial hypertension
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()] ]]
Description
(extracted from source data)
DESCRIPTION
A cyclic peptide
(GtoPdb)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
10
Cayman Chemical Bioactives
Drug Repurposing Hub
DrugBank
DrugMAP
Guide to Pharmacology
Mcule NIBR MoA Box Subset
MedChem Express Bioactive Compound Library
Novartis Chemogenetic Library (NIBR MoA Box)
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
22
Molecular Weight
610.31
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
6
Rotatable Bonds
7
Ring Count
4
Aromatic Ring Count
2
cLogP
0.83
TPSA
189.8
Fraction CSP3
0.55
Chiral centers
5.0
Largest ring
15.0
QED
0.27
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
GPCR/G protein
Target
Endothelin A Receptor
EDNRA
Endothelin Receptor
Member status
member
MOA
Endothelin ETA Receptor Antagonists
Endothelin Receptor antagonist
Source data
