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Ligand

NameCHEMBL1917358
Molecular formulaC24H35N3O2S
IUPAC nameN-[4-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)butyl]-N-ethylquinoline-3-sulfonamide
Molecular weight429.623
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.9
SynonymsBDBM50357992
Inchi KeyABMOEXQUVMIFAR-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H35N3O2S/c1-2-27(30(28,29)23-17-21-10-5-6-12-24(21)25-18-23)15-8-7-14-26-16-13-20-9-3-4-11-22(20)19-26/h5-6,10,12,17-18,20,22H,2-4,7-9,11,13-16,19H2,1H3
PubChem CID57400830
ChEMBLCHEMBL1917358
IUPHARN/A
BindingDB50357992
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
9615-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
9625-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
9605-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
9595-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479

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