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Ligand

NameSMR000130166
Molecular formulaC22H28N4O3
IUPAC nameN-[1-(cyclopentylcarbamoyl)cyclohexyl]-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
Molecular weight396.491
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.4
SynonymsAC1NDO8A
AKOS003636481
BDBM62084
CHEMBL1371990
cid_4579040
[ Show all ]
Inchi KeyBXSQZDXBPVRFFZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H28N4O3/c27-20(19-15-23-12-13-24-19)26(16-18-9-6-14-29-18)22(10-4-1-5-11-22)21(28)25-17-7-2-3-8-17/h6,9,12-15,17H,1-5,7-8,10-11,16H2,(H,25,28)
PubChem CID4579040
ChEMBLCHEMBL1371990
IUPHARN/A
BindingDB62084
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
35401Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
35400Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
35404Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
35403Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
35402Neuropeptides B/W receptor type 1P48145NPBWR1Homo sapiens (Human)328

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