General
Preferred name
BX 471
Synonyms
BX-471 ()
ZK-811752 ()
BX471 ()
ZK811752 ()
BX471 (hydrochloride) ()
BX 471 free base ()
ZK-811752 (hydrochloride) ()
ZK811752, BAY 865047, SH T 04268H ()
BX-741 ()
BAY-865047 ()
BAY-86-5047 ()
BAY86-5047 ()
P&D ID
PD013010
CAS
217645-70-0
288262-96-4
Tags
available
drug candidate
Drug indication
Discovery agent
Drug Status
investigational
Max Phase
Phase 2
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Potent, selective CCR1 antagonist.
DESCRIPTION BX 471 is a potent, selective and orally active CCR1 antagonist . (GtoPdb)
DESCRIPTION Highly selective beta1-adrenoceptor antagonist (Tocris Bioactive Compound Library)
DESCRIPTION Potent, selective CCR1 antagonist (Tocriscreen Plus)
Compound Sets
20
Axon Medchem Screening Library
Cayman Chemical Bioactives
Concise Guide to Pharmacology 2017/18
Concise Guide to Pharmacology 2019/20
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
Drug Repurposing Hub
DrugMAP
EU-OPENSCREEN Bioactive Compound Library
Guide to Pharmacology
JUMP-Target 1 Compound Set
Mcule NIBR MoA Box Subset
MedChem Express Bioactive Compound Library
Novartis Chemogenetic Library (NIBR MoA Box)
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
Tocris Bioactive Compound Library
Tocriscreen Plus
External IDs
36
Properties
(calculated by RDKit )
Molecular Weight
434.15
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
2
Rotatable Bonds
6
Ring Count
3
Aromatic Ring Count
2
cLogP
3.08
TPSA
87.9
Fraction CSP3
0.33
Chiral centers
1.0
Largest ring
6.0
QED
0.73
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target Type
7-TM Receptors
Pathway
Immunology/Inflammation
Microbiology&virology
GPCR/G protein
Target
human CCR1
CCR1
CCR1 antagonist
CCR
Primary Target
Chemokine CC Receptors
MOA
Antagonist
Chemokine CCR1 Antagonists
CC chemokine receptor antagonist
Member status
member
Source data