General
Preferred name
SB-271046
Synonyms
SB 271046 hydrochloride ()
SB-271046A ()
SB 271046 (Hydrochloride) ()
SB 271046A ()
SB271046 ()
SB 271046 ()
SB-271046 (hydrochloride) ()
P&D ID
PD010546
CAS
209481-24-3
209481-20-9
Tags
available
drug candidate
Drug indication
Discovery agent
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 and selective PAR2 agonist (Tocris Bioactive Compound Library)
DESCRIPTION Selective, orally active 5-HT6 antagonist (Tocriscreen Plus)
DESCRIPTION SB-271046 is found to be a competitive antagonist with a pA2 of 8.7 in the functional adenylyl cyclase assay which is in good agreement with its binding affinity. (BOC Sciences Bioactive Compounds)
Compound Sets
16
Axon Medchem Screening Library
BOC Sciences Bioactive Compounds
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
Guide to Pharmacology
MedChem Express Bioactive Compound Library
ReFrame library
Selleckchem Bioactive Compound Library
Tocris Bioactive Compound Library
Tocriscreen Plus
ZINC Tool Compounds
External IDs
36
Properties
(calculated by RDKit )
Molecular Weight
451.08
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
2
Rotatable Bonds
5
Ring Count
4
Aromatic Ring Count
3
cLogP
4.08
TPSA
70.67
Fraction CSP3
0.3
Chiral centers
0.0
Largest ring
6.0
QED
0.61
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target Type
7-TM Receptors
Primary Target
5-HT6 Receptors
MOA
Antagonist
serotonin receptor antagonist
Target
HTR6
5-HT6 antagonist
5-HT Receptor
Pathway
GPCR/G protein
Neuronal Signaling
Solubility
Soluble in DMSO (100 mM), and ethanol (50 mM)
Source data