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Ligand

NameCHEMBL420718
Molecular formulaC27H31N5O2
IUPAC name6-indol-1-yl-2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]pyridazin-3-one
Molecular weight457.578
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.9
SynonymsBDBM50117128
6-(1H-indol-1-yl)-2-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)pyridazin-3(2H)-one
6-Indol-1-yl-2-{4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-butyl}-2H-pyridazin-3-one
Inchi KeyAENMCUGUMJQVHK-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H31N5O2/c1-34-25-11-5-4-10-24(25)30-20-18-29(19-21-30)15-6-7-16-32-27(33)13-12-26(28-32)31-17-14-22-8-2-3-9-23(22)31/h2-5,8-14,17H,6-7,15-16,18-21H2,1H3
PubChem CID10072826
ChEMBLCHEMBL420718
IUPHARN/A
BindingDB50117128
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
36605-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422

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