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Ligand

NameCHEMBL176807
Molecular formulaC17H17N5O
IUPAC name1-[[4-(1H-imidazol-5-ylmethyl)phenyl]methyl]-3-pyridin-3-ylurea
Molecular weight307.357
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP1.4
Synonyms1-[4-(1H-Imidazol-4-ylmethyl)-benzyl]-3-pyridin-3-yl-urea
BDBM50112022
1-[4-(4-Imidazolylmethyl)benzyl]-3-(3-pyridinyl)urea
Inchi KeyCQXUMDKFHPMKDN-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H17N5O/c23-17(22-15-2-1-7-18-10-15)20-9-14-5-3-13(4-6-14)8-16-11-19-12-21-16/h1-7,10-12H,8-9H2,(H,19,21)(H2,20,22,23)
PubChem CID44385291
ChEMBLCHEMBL176807
IUPHARN/A
BindingDB50112022
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
48574Histamine H3 receptorQ9JI35HRH3Cavia porcellus (Guinea pig)445

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