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Ligand

NameCHEMBL2349313
Molecular formulaC19H24N4O2S2
IUPAC name7-[[(2R)-1-hydroxy-4-methylpentan-2-yl]amino]-5-[(1R)-1-phenylethyl]sulfanyl-3H-[1,3]thiazolo[4,5-d]pyrimidin-2-one
Molecular weight404.547
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP4.4
SynonymsBDBM50432449
SCHEMBL213766
Inchi KeyIAGWEZFSRRPOSS-TZMCWYRMSA-N
Inchi IDInChI=1S/C19H24N4O2S2/c1-11(2)9-14(10-24)20-16-15-17(23-19(25)27-15)22-18(21-16)26-12(3)13-7-5-4-6-8-13/h4-8,11-12,14,24H,9-10H2,1-3H3,(H2,20,21,22,23,25)/t12-,14-/m1/s1
PubChem CID11857486
ChEMBLCHEMBL2349313
IUPHARN/A
BindingDB50432449
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
128392C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360
128391CX3C chemokine receptor 1P49238CX3CR1Homo sapiens (Human)355

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