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Ligand

NameMLS001157638
Molecular formulaC27H28N4O3
IUPAC nameN-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-2-(furan-2-yl)quinoline-4-carboxamide
Molecular weight456.546
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.8
Synonymscid_24819417
NCGC00300854-01
AB00868641-06
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-2-(furan-2-yl)quinoline-4-carboxamide
HMS2974H21
[ Show all ]
Inchi KeyCCWOXRNCXQXGKI-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H28N4O3/c1-3-31(4-2)16-15-28-26(32)19-11-13-20(14-12-19)29-27(33)22-18-24(25-10-7-17-34-25)30-23-9-6-5-8-21(22)23/h5-14,17-18H,3-4,15-16H2,1-2H3,(H,28,32)(H,29,33)
PubChem CID24819417
ChEMBLCHEMBL1313501
IUPHARN/A
BindingDB76141
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
39018Apelin receptorP35414APLNRHomo sapiens (Human)380
39017Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
39016Type-1 angiotensin II receptorP30556AGTR1Homo sapiens (Human)359

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