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Ligand

NameCHEMBL411504
Molecular formulaC24H31N3O4S
IUPAC name2-tert-butyl-5-(2-ethoxypyridin-4-yl)sulfonyl-1-(oxan-4-ylmethyl)benzimidazole
Molecular weight457.589
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.1
SynonymsBDBM50364081
SCHEMBL13605940
Inchi KeyABBJGBXBPXOWOG-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H31N3O4S/c1-5-31-22-15-19(8-11-25-22)32(28,29)18-6-7-21-20(14-18)26-23(24(2,3)4)27(21)16-17-9-12-30-13-10-17/h6-8,11,14-15,17H,5,9-10,12-13,16H2,1-4H3
PubChem CID24794709
ChEMBLCHEMBL411504
IUPHARN/A
BindingDB50364081
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
722Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
723Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360

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