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Ligand

NameCHEMBL606629
Molecular formulaC18H17ClF6N2O2S
IUPAC name(2S)-2-(4-chlorophenyl)-N-[5-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]-3,3-dimethylbutanamide
Molecular weight474.846
Hydrogen bond acceptor10
Hydrogen bond donor2
XlogP5.7
SynonymsBDBM50305917
(S)-2-(4-chlorophenyl)-N-(5-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)thiazol-2-yl)-3,3-dimethylbutanamide
Inchi KeyGVUGZEAXWZZCPP-LBPRGKRZSA-N
Inchi IDInChI=1S/C18H17ClF6N2O2S/c1-15(2,3)12(9-4-6-10(19)7-5-9)13(28)27-14-26-8-11(30-14)16(29,17(20,21)22)18(23,24)25/h4-8,12,29H,1-3H3,(H,26,27,28)/t12-/m0/s1
PubChem CID46226312
ChEMBLCHEMBL606629
IUPHARN/A
BindingDB50305917
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
106603Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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