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Ligand

NameCHEMBL2349302
Molecular formulaC19H22ClN5O2S2
IUPAC namemethyl (2R)-2-[[2-amino-5-[(2-chlorophenyl)methylsulfanyl]-[1,3]thiazolo[4,5-d]pyrimidin-7-yl]amino]-4-methylpentanoate
Molecular weight451.988
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP5.6
SynonymsBDBM50432456
Inchi KeyQYYTVPCDMRVGDU-CYBMUJFWSA-N
Inchi IDInChI=1S/C19H22ClN5O2S2/c1-10(2)8-13(17(26)27-3)22-15-14-16(23-18(21)29-14)25-19(24-15)28-9-11-6-4-5-7-12(11)20/h4-7,10,13H,8-9H2,1-3H3,(H3,21,22,23,24,25)/t13-/m1/s1
PubChem CID71625019
ChEMBLCHEMBL2349302
IUPHARN/A
BindingDB50432456
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
290212C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360
290213CX3C chemokine receptor 1P49238CX3CR1Homo sapiens (Human)355

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