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Ligand

NameCHEMBL3700332
Molecular formulaC18H27N5O3
IUPAC name[1-(6-oxo-1H-pyridazin-3-yl)piperidin-4-yl] 4-cyclobutylpiperazine-1-carboxylate
Molecular weight361.446
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP0.5
SynonymsAKBDWSBBADJJLP-UHFFFAOYSA-N
SCHEMBL15548381
1-(6-oxo-1,6-dihydropyridazin-3-yl)piperidin-4-yl 4-cyclobutylpiperazine-1-carboxylate
Inchi KeyAKBDWSBBADJJLP-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H27N5O3/c24-17-5-4-16(19-20-17)22-8-6-15(7-9-22)26-18(25)23-12-10-21(11-13-23)14-2-1-3-14/h4-5,14-15H,1-3,6-13H2,(H,20,24)
PubChem CID72948212
ChEMBLCHEMBL3700332
IUPHARN/A
BindingDB159244
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
459285Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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