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Ligand

NameCHEMBL418692
Molecular formulaC26H33N3O3
IUPAC name1-[1-[4-(5-aminopentoxy)benzoyl]piperidin-4-yl]-3,4-dihydroquinolin-2-one
Molecular weight435.568
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.1
SynonymsBDBM50045158
SCHEMBL7287368
1-{1-[4-(5-Amino-pentyloxy)-benzoyl]-piperidin-4-yl}-3,4-dihydro-1H-quinolin-2-one
Inchi KeyBNICCTVCUCXRHZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H33N3O3/c27-16-4-1-5-19-32-23-11-8-21(9-12-23)26(31)28-17-14-22(15-18-28)29-24-7-3-2-6-20(24)10-13-25(29)30/h2-3,6-9,11-12,22H,1,4-5,10,13-19,27H2
PubChem CID14969546
ChEMBLCHEMBL418692
IUPHARN/A
BindingDB50045158
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
28139Vasopressin V1a receptorP30560Avpr1aRattus norvegicus (Rat)424
28140Vasopressin V2 receptorQ00788Avpr2Rattus norvegicus (Rat)371

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