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Ligand

NameCHEMBL236475
Molecular formulaC22H25ClN2O2
IUPAC name1-[2-(4-chlorophenoxy)-5-(4-morpholin-4-ylbut-1-ynyl)phenyl]-N-methylmethanamine
Molecular weight384.904
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.8
Synonyms(2-(4-chlorophenoxy)-5-(4-morpholinobut-1-ynyl)phenyl)-N-methylmethanamine
BDBM50217566
SCHEMBL2887495
Inchi KeyAGFIIERRTNLUMS-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25ClN2O2/c1-24-17-19-16-18(4-2-3-11-25-12-14-26-15-13-25)5-10-22(19)27-21-8-6-20(23)7-9-21/h5-10,16,24H,3,11-15,17H2,1H3
PubChem CID24964160
ChEMBLCHEMBL236475
IUPHARN/A
BindingDB50217566
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
4831Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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