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Ligand

NameCHEMBL462588
Molecular formulaC23H38N4S2
IUPAC name5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-ylmethyl N'-(4-tert-butylcyclohexyl)-N-cyclohexylcarbamimidothioate
Molecular weight434.705
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.3
SynonymsBDBM50247095
1-(4-tert-butylcyclohexyl)-3-cyclohexyl-2-((5,6-dihydroimidazo[2,1-b]thiazol-3-yl)methyl)isothiourea
Inchi KeyARVJDGCNDRWPJH-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H38N4S2/c1-23(2,3)17-9-11-19(12-10-17)26-21(25-18-7-5-4-6-8-18)28-15-20-16-29-22-24-13-14-27(20)22/h16-19H,4-15H2,1-3H3,(H,25,26)
PubChem CID25178569
ChEMBLCHEMBL462588
IUPHARN/A
BindingDB50247095
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
12804C-X-C chemokine receptor type 4P61073CXCR4Homo sapiens (Human)352

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