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Ligand

NameCHEMBL2431058
Molecular formulaC21H19N5OS2
IUPAC name(2S)-3-phenyl-N-(5-pyridin-4-yl-1,3-thiazol-2-yl)-2-(1,3-thiazol-5-ylmethylamino)propanamide
Molecular weight421.537
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.2
SynonymsBDBM50440703
Inchi KeyGJOHVGHWKIFLND-SFHVURJKSA-N
Inchi IDInChI=1S/C21H19N5OS2/c27-20(26-21-25-13-19(29-21)16-6-8-22-9-7-16)18(10-15-4-2-1-3-5-15)24-12-17-11-23-14-28-17/h1-9,11,13-14,18,24H,10,12H2,(H,25,26,27)/t18-/m0/s1
PubChem CID72945362
ChEMBLCHEMBL2431058
IUPHARN/A
BindingDB50440703
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
98102Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462

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