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Ligand

NameCHEMBL2069589
Molecular formulaC21H20N6O2S
IUPAC name(2S)-N-[2-oxo-5-(1H-pyrazol-5-yl)-1H-pyridin-3-yl]-3-phenyl-2-(1,3-thiazol-4-ylmethylamino)propanamide
Molecular weight420.491
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP1.3
SynonymsBDBM50390609
Inchi KeyUFIHOFMGHSWUFF-SFHVURJKSA-N
Inchi IDInChI=1S/C21H20N6O2S/c28-20-19(9-15(10-23-20)17-6-7-25-27-17)26-21(29)18(8-14-4-2-1-3-5-14)22-11-16-12-30-13-24-16/h1-7,9-10,12-13,18,22H,8,11H2,(H,23,28)(H,25,27)(H,26,29)/t18-/m0/s1
PubChem CID136232856
ChEMBLCHEMBL2069589
IUPHARN/A
BindingDB50390609
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
567765Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462

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