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Ligand

NameCHEMBL237179
Molecular formulaC20H22ClN3O2S
IUPAC name3-(4-chlorophenyl)sulfonyl-1-(1-ethylpiperidin-3-yl)pyrrolo[2,3-b]pyridine
Molecular weight403.925
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.5
SynonymsBDBM50217886
1-(1-ethylpiperidin-3-yl)-3-[(4-chlorophenyl)sulfonyl]-1H-pyrrolo[2,3-b]pyridine
Inchi KeyALCXYHPCAIHWAC-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H22ClN3O2S/c1-2-23-12-4-5-16(13-23)24-14-19(18-6-3-11-22-20(18)24)27(25,26)17-9-7-15(21)8-10-17/h3,6-11,14,16H,2,4-5,12-13H2,1H3
PubChem CID44435632
ChEMBLCHEMBL237179
IUPHARN/A
BindingDB50217886
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
81495-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440

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