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Ligand

NameCHEMBL2349303
Molecular formulaC19H23N5O2S2
IUPAC namemethyl (2R)-2-[(2-amino-5-benzylsulfanyl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl)amino]-4-methylpentanoate
Molecular weight417.546
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP4.9
SynonymsBDBM50432455
Inchi KeyWFPLQCUVOVCACX-CYBMUJFWSA-N
Inchi IDInChI=1S/C19H23N5O2S2/c1-11(2)9-13(17(25)26-3)21-15-14-16(22-18(20)28-14)24-19(23-15)27-10-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3,(H3,20,21,22,23,24)/t13-/m1/s1
PubChem CID71625020
ChEMBLCHEMBL2349303
IUPHARN/A
BindingDB50432455
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
372082C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360
372081CX3C chemokine receptor 1P49238CX3CR1Homo sapiens (Human)355

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