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Ligand

NameCHEMBL2164853
Molecular formulaC29H27N5O4
IUPAC name2-[2-oxo-3-[[(2S)-3-phenyl-2-[(1-pyridin-2-ylcyclopropyl)amino]propanoyl]amino]-5-pyridin-4-ylpyridin-1-yl]acetic acid
Molecular weight509.566
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP-0.4
SynonymsBDBM50395782
Inchi KeyHMKFDOZNUOXRMB-QHCPKHFHSA-N
Inchi IDInChI=1S/C29H27N5O4/c35-26(36)19-34-18-22(21-9-14-30-15-10-21)17-24(28(34)38)32-27(37)23(16-20-6-2-1-3-7-20)33-29(11-12-29)25-8-4-5-13-31-25/h1-10,13-15,17-18,23,33H,11-12,16,19H2,(H,32,37)(H,35,36)/t23-/m0/s1
PubChem CID71458768
ChEMBLCHEMBL2164853
IUPHARN/A
BindingDB50395782
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
118697Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462

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