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Ligand

NameOpc 21268
Molecular formulaC26H31N3O4
IUPAC nameN-[3-[4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)piperidine-1-carbonyl]phenoxy]propyl]acetamide
Molecular weight449.551
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.6
SynonymsFT-0700164
N-(3-(4-(4-(2-oxo-3,4-dihydroquinolin-1(2H)-yl)piperidine-1-carbonyl)phenoxy)propyl)acetamide
OPC-21268
ACMC-20mu6h
CTK0H6673
[ Show all ]
Inchi KeyKSNUCNRMDYJBKT-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H31N3O4/c1-19(30)27-15-4-18-33-23-10-7-21(8-11-23)26(32)28-16-13-22(14-17-28)29-24-6-3-2-5-20(24)9-12-25(29)31/h2-3,5-8,10-11,22H,4,9,12-18H2,1H3,(H,27,30)
PubChem CID114904
ChEMBLCHEMBL296908
IUPHAR2196
BindingDB50029644
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
177196Oxytocin receptorP30559OXTRHomo sapiens (Human)389
177199Oxytocin receptorP70536OxtrRattus norvegicus (Rat)388
177194Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418
177198Vasopressin V1a receptorP30560Avpr1aRattus norvegicus (Rat)424
177197Vasopressin V1b receptorP48974Avpr1bRattus norvegicus (Rat)425
177195Vasopressin V2 receptorQ00788Avpr2Rattus norvegicus (Rat)371
177200Vasopressin V2 receptorP30518AVPR2Homo sapiens (Human)371

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