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Ligand

NameCHEMBL511794
Molecular formulaC18H23N3OS
IUPAC name8-[(1-ethylpiperidin-4-yl)methoxy]-3-methyl-5-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
Molecular weight329.462
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.7
SynonymsBDBM50413544
Inchi KeyAGRWERLWTNBCHT-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H23N3OS/c1-3-20-9-6-14(7-10-20)11-22-17-15-5-4-8-21(15)16-13(2)12-23-18(16)19-17/h4-5,8,12,14H,3,6-7,9-11H2,1-2H3
PubChem CID44592188
ChEMBLCHEMBL511794
IUPHARN/A
BindingDB50413544
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
51545-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388

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