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Ligand

NameCHEMBL130356
Molecular formulaC18H22N2O
IUPAC name4-[2-[1-(cyclopropylmethyl)piperidin-4-yl]acetyl]benzonitrile
Molecular weight282.387
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP2.8
SynonymsCHEMBL137776
SCHEMBL7357328
ZINC5428
BDBM50002245
XJ-448
[ Show all ]
Inchi KeyPEWGDLTXNPKKLN-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H22N2O/c19-12-15-3-5-17(6-4-15)18(21)11-14-7-9-20(10-8-14)13-16-1-2-16/h3-6,14,16H,1-2,7-11,13H2
PubChem CID9795762
ChEMBLCHEMBL130356
IUPHARN/A
BindingDB50002245
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
258011D(1A) dopamine receptorQ61616Drd1Mus musculus (Mouse)446
258010D(2) dopamine receptorP20288DRD2Bos taurus (Bovine)444
461452D(2) dopamine receptorP61168Drd2Mus musculus (Mouse)444

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