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Ligand

NameCHEMBL2431066
Molecular formulaC23H21N5O2S
IUPAC name(2S)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenyl-2-(1,3-thiazol-5-ylmethylamino)propanamide
Molecular weight431.514
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP1.9
SynonymsBDBM50440706
Inchi KeyFJSJFYVNNFBLQG-FQEVSTJZSA-N
Inchi IDInChI=1S/C23H21N5O2S/c29-22-21(11-18(12-27-22)17-6-8-24-9-7-17)28-23(30)20(10-16-4-2-1-3-5-16)26-14-19-13-25-15-31-19/h1-9,11-13,15,20,26H,10,14H2,(H,27,29)(H,28,30)/t20-/m0/s1
PubChem CID73352401
ChEMBLCHEMBL2431066
IUPHARN/A
BindingDB50440706
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
80028Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462

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