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Ligand

NameCHEMBL449406
Molecular formulaC21H24N4O
IUPAC name3-methyl-N-[3-(1-methylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]benzamide
Molecular weight348.45
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP3.2
Synonyms3-Methyl-N-[3-(1-methyl-piperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-benzamide
5-(N-[3-methylbenzoyl]amino)-3-(1-methylpiperidin-4-yl)pyrrolo[3,2-b]pyridine
BDBM50130436
JZEMGYDWCXCAQQ-UHFFFAOYSA-N
SCHEMBL7007762
Inchi KeyJZEMGYDWCXCAQQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H24N4O/c1-14-4-3-5-16(12-14)21(26)24-19-7-6-18-20(23-19)17(13-22-18)15-8-10-25(2)11-9-15/h3-7,12-13,15,22H,8-11H2,1-2H3,(H,23,24,26)
PubChem CID10926112
ChEMBLCHEMBL449406
IUPHARN/A
BindingDB50130436
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1636475-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1636445-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
1636465-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
1636455-hydroxytryptamine receptor 1FP30939HTR1FHomo sapiens (Human)366

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