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Ligand

NameCHEMBL271839
Molecular formulaC23H31NO2
IUPAC name[6-methyl-1-(oxan-4-ylmethyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone
Molecular weight353.506
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP4.7
SynonymsSCHEMBL2076363
BDBM21291
Tetrahydropyranyl-methyl analogue, 12
6-methyl-1-(oxan-4-ylmethyl)-3-[(2,2,3,3-tetramethylcyclopropyl)carbonyl]-1H-indole
Inchi KeyACYBOEVFMUHYEK-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H31NO2/c1-15-6-7-17-18(20(25)21-22(2,3)23(21,4)5)14-24(19(17)12-15)13-16-8-10-26-11-9-16/h6-7,12,14,16,21H,8-11,13H2,1-5H3
PubChem CID11559434
ChEMBLCHEMBL271839
IUPHARN/A
BindingDB21291
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2025Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
2024Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360

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