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Ligand

NameCHEMBL85602
Molecular formulaC23H28N2OS
IUPAC name2a-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butyl]-1-methyl-4,5-dihydro-3H-benzo[cd]indol-2-one
Molecular weight380.55
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.1
Synonyms1-Methyl-2a-[4-(4,5,6,7-tetrahydrothieno[3,2-c]pyridine-5-yl)butyl]-1,2,2a,3,4,5-hexahydrobenzo[cd]indol-2-one
SCHEMBL6423798
Inchi KeyBETVPTZOBIULKH-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H28N2OS/c1-24-19-8-4-6-17-7-5-12-23(21(17)19,22(24)26)11-2-3-13-25-14-9-20-18(16-25)10-15-27-20/h4,6,8,10,15H,2-3,5,7,9,11-14,16H2,1H3
PubChem CID11740526
ChEMBLCHEMBL85602
IUPHARN/A
BindingDBN/A
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
219105-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
219135-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
219145-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
219125-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388
219115-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
219155-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479

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