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Ligand

NameCHEMBL61675
Molecular formulaC21H25FN6
IUPAC name1-[3-(3-fluorophenyl)-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
Molecular weight380.471
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP2.4
SynonymsBDBM50406068
SCHEMBL7290048
1-[3-(3-Fluorophenyl)-3-(2-pyridyl)propyl]-3-[3-(1H-imidazol-4-yl)propyl]guanidine
Inchi KeyBFIAWQUMMUHFNN-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H25FN6/c22-17-6-3-5-16(13-17)19(20-8-1-2-10-25-20)9-12-27-21(23)26-11-4-7-18-14-24-15-28-18/h1-3,5-6,8,10,13-15,19H,4,7,9,11-12H2,(H,24,28)(H3,23,26,27)
PubChem CID14660357
ChEMBLCHEMBL61675
IUPHARN/A
BindingDB50406068
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
22338Histamine H1 receptorP31389HRH1Cavia porcellus (Guinea pig)488
22337Histamine H2 receptorP47747HRH2Cavia porcellus (Guinea pig)359

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