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Ligand

NameCHEMBL380777
Molecular formulaC18H19N3O3S
IUPAC name2,4-dimethyl-5-[3-(1,2,3,6-tetrahydropyridin-5-yl)indol-1-yl]sulfonyl-1,3-oxazole
Molecular weight357.428
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.5
SynonymsBDBM50172288
1-(2,4-Dimethyl-oxazole-5-sulfonyl)-3-(1,2,5,6-tetrahydro-pyridin-3-yl)-1H-indole
Inchi KeyAHMBKTMJOBDXMV-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H19N3O3S/c1-12-18(24-13(2)20-12)25(22,23)21-11-16(14-6-5-9-19-10-14)15-7-3-4-8-17(15)21/h3-4,6-8,11,19H,5,9-10H2,1-2H3
PubChem CID44403091
ChEMBLCHEMBL380777
IUPHARN/A
BindingDB50172288
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
56655-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440

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