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Ligand

NameCHEMBL103058
Molecular formulaC16H20N4O
IUPAC nameN-[3-(1-ethyl-3,6-dihydro-2H-pyridin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]acetamide
Molecular weight284.363
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP1.2
Synonyms5-(N-[acetyl]amino)-3-(1-ethyl-1,2,3,6-tetrahydropyridin-4-yl)pyrrolo[3,2-b]pyridine
BDBM50130424
CINLYSVVMFMYQH-UHFFFAOYSA-N
N-[3-(1-Ethyl-1,2,3,6-tetrahydro-pyridin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-acetamide
SCHEMBL7008686
Inchi KeyCINLYSVVMFMYQH-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H20N4O/c1-3-20-8-6-12(7-9-20)13-10-17-14-4-5-15(18-11(2)21)19-16(13)14/h4-6,10,17H,3,7-9H2,1-2H3,(H,18,19,21)
PubChem CID10880608
ChEMBLCHEMBL103058
IUPHARN/A
BindingDB50130424
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
428205-hydroxytryptamine receptor 1FP30939HTR1FHomo sapiens (Human)366

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