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Ligand

NameCHEMBL2164857
Molecular formulaC21H21N7OS2
IUPAC name(2S)-N-[5-[2-(methylamino)pyridin-4-yl]-1,3,4-thiadiazol-2-yl]-3-phenyl-2-(1,3-thiazol-4-ylmethylamino)propanamide
Molecular weight451.567
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP2.9
SynonymsBDBM50395775
SCHEMBL6028904
Inchi KeyBQOUXRFZMULETF-KRWDZBQOSA-N
Inchi IDInChI=1S/C21H21N7OS2/c1-22-18-10-15(7-8-23-18)20-27-28-21(31-20)26-19(29)17(9-14-5-3-2-4-6-14)24-11-16-12-30-13-25-16/h2-8,10,12-13,17,24H,9,11H2,1H3,(H,22,23)(H,26,28,29)/t17-/m0/s1
PubChem CID69641837
ChEMBLCHEMBL2164857
IUPHARN/A
BindingDB50395775
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
30507Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462
30508Probable G-protein coupled receptor 142Q7TQN9Gpr142Mus musculus (Mouse)365

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