General
Preferred name
m-Chlorophenylbiguanide hydrochloride
Synonyms
1-(m-Chlorophenyl)-biguanide hydrochloride ()
m-CPBG (hydrochloride) ()
1-(3-Chlorophenyl)biguanide (hydrochloride) ()
1-carbamimidamido-N-(3-chlorophenyl)methanimidamide ()
P&D ID
PD015298
CAS
2113-05-5
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 29
DESCRIPTION m-Chlorophenylbiguanide hydrochloride is a 5-HT3 receptor agonist. m-Chlorophenylbiguanide hydrochloride selectively binds 5-HT3(Ki: 0.002 ??M) over 5-HT1A(Ki: 10 ??M) and 5-HT2(Ki: 10 ??M) receptors but also binds to high and low affinity sites on the dopamine transporter(DAT; IC50s: 0.4 and 34.8 ??M, respectively, in rat caudate putamen synaptosomal membranes).
DESCRIPTION 5-HT3 serotonergic receptor agonist (LOPAC library)
DESCRIPTION m-Chlorophenylbiguanide hydrochloride is the hydrochloride salt of chlorophenylbiguanide, which is a selective and prototypical potent 5-HT3 serotonin receptor agonist. (BOC Sciences Bioactive Compounds)
DESCRIPTION Potent and specific 5-HT3 agonist (Tocriscreen Total)
DESCRIPTION Binding affinity towards 5-hydroxytryptamine 3 receptor (TargetMol Bioactive Compound Library)
DESCRIPTION Positive allosteric modulator of benzodiazepine site (Tocris Bioactive Compound Library)
Cell lines
0
Organisms
1
Compound Sets
7
BOC Sciences Bioactive Compounds
m-chlorophenylbiguanide-hydrochloride-cas-2113-05-5-item-57635
Cayman Chemical Bioactives
34726
LOPAC library
MedChem Express Bioactive Compound Library
HY-100938
TargetMol Bioactive Compound Library
Y021-1613
Tocris Bioactive Compound Library
0440
Tocriscreen Total
External IDs
19
Properties
(calculated by RDKit )
Molecular Weight
247.04
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
5
Rotatable Bonds
1
Ring Count
1
Aromatic Ring Count
1
cLogP
1.59
TPSA
97.78
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.39
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Selectivity
5-HT3
Primary Target
5-HT3 Receptors
MOA
Agonist
Pathway
GPCR/G protein
Neuronal Signaling
Target
5-HT Receptor
Source data