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Ligand

NameCHEMBL340413
Molecular formulaC21H27Cl2N3O4
IUPAC name5-(8-azaspiro[4.5]decan-8-ylamino)-4-[(3,5-dichlorobenzoyl)amino]-5-oxopentanoic acid
Molecular weight456.364
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP2.2
SynonymsBDBM50008172
4-(8-Aza-spiro[4.5]dec-8-ylcarbamoyl)-4-(3,5-dichloro-benzoylamino)-butyric acid
Inchi KeyCOZGZMCLUAHPHG-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H27Cl2N3O4/c22-15-11-14(12-16(23)13-15)19(29)24-17(3-4-18(27)28)20(30)25-26-9-7-21(8-10-26)5-1-2-6-21/h11-13,17H,1-10H2,(H,24,29)(H,25,30)(H,27,28)
PubChem CID44349069
ChEMBLCHEMBL340413
IUPHARN/A
BindingDB50008172
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
47151Cholecystokinin receptor type AP30551CckarRattus norvegicus (Rat)444
47152Gastrin/cholecystokinin type B receptorP30553CckbrRattus norvegicus (Rat)452
47153Gastrin/cholecystokinin type B receptorP32239CCKBRHomo sapiens (Human)447

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