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Ligand

NameCHEMBL2349327
Molecular formulaC19H25N5O2S2
IUPAC name(2R)-2-[[2-amino-5-[(2-methoxyphenyl)methylsulfanyl]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]amino]-4-methylpentan-1-ol
Molecular weight419.562
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP4.3
SynonymsBDBM50432434
SCHEMBL5235451
Inchi KeyYIKGYASPCLWXCD-CYBMUJFWSA-N
Inchi IDInChI=1S/C19H25N5O2S2/c1-11(2)8-13(9-25)21-16-15-17(22-18(20)28-15)24-19(23-16)27-10-12-6-4-5-7-14(12)26-3/h4-7,11,13,25H,8-10H2,1-3H3,(H3,20,21,22,23,24)/t13-/m1/s1
PubChem CID71625275
ChEMBLCHEMBL2349327
IUPHARN/A
BindingDB50432434
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
410949C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360
410950CX3C chemokine receptor 1P49238CX3CR1Homo sapiens (Human)355

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