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Ligand

NameSCHEMBL842188
Molecular formulaC14H18N6OS3
IUPAC name2-[[2-amino-5-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]amino]-2-methylpropan-1-ol
Molecular weight382.519
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogP2.7
SynonymsCHEMBL233264
Inchi KeyBJIJCFPWEFGUKA-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H18N6OS3/c1-7-16-8(4-22-7)5-23-13-18-10-9(24-12(15)17-10)11(19-13)20-14(2,3)6-21/h4,21H,5-6H2,1-3H3,(H3,15,17,18,19,20)
PubChem CID22288470
ChEMBLCHEMBL233264
IUPHARN/A
BindingDBN/A
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
25139C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360

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