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Ligand

NameCHEMBL3692880
Molecular formulaC18H17NO3S
IUPAC name8-(benzenesulfonyl)-2,3,4,5-tetrahydro-1H-[1]benzofuro[3,2-c]azepine
Molecular weight327.398
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.9
SynonymsBDBM166211
SCHEMBL10346104
US9067949, 68
Inchi KeyAACBLUDFPRDGJC-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H17NO3S/c20-23(21,13-5-2-1-3-6-13)14-8-9-15-16-12-19-10-4-7-17(16)22-18(15)11-14/h1-3,5-6,8-9,11,19H,4,7,10,12H2
PubChem CID68108670
ChEMBLCHEMBL3692880
IUPHARN/A
BindingDB166211
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
4592345-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440

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