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Ligand

NameCHEMBL1777872
Molecular formulaC26H25NO3S
IUPAC name3-[4-[[2-(4-methylphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-yl]oxy]phenyl]hex-4-ynoic acid
Molecular weight431.55
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.6
SynonymsBDBM50344078
rac-3-(4-(2-p-tolyl-4,5,6,7-tetrahydrobenzo[d]thiazol-7-yloxy)phenyl)hex-4-ynoic acid
Inchi KeyRDGSLINMZIQBIF-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H25NO3S/c1-3-5-20(16-24(28)29)18-12-14-21(15-13-18)30-23-7-4-6-22-25(23)31-26(27-22)19-10-8-17(2)9-11-19/h8-15,20,23H,4,6-7,16H2,1-2H3,(H,28,29)
PubChem CID54583582
ChEMBLCHEMBL1777872
IUPHARN/A
BindingDB50344078
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
293339Free fatty acid receptor 1O14842FFAR1Homo sapiens (Human)300
293340Free fatty acid receptor 1Q76JU9Ffar1Mus musculus (Mouse)300

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