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Ligand

NameCHEMBL2057501
Molecular formulaC18H20F3N5O3S2
IUPAC name[1-[[2-methyl-4-(trifluoromethyl)-1,3-thiazol-5-yl]sulfonyl]azetidin-3-yl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
Molecular weight475.505
Hydrogen bond acceptor11
Hydrogen bond donor0
XlogP1.5
SynonymsBDBM50387789
SCHEMBL15102025
Inchi KeyAAEYDFXKGIXSDP-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H20F3N5O3S2/c1-12-23-15(18(19,20)21)17(30-12)31(28,29)26-10-13(11-26)16(27)25-8-6-24(7-9-25)14-2-4-22-5-3-14/h2-5,13H,6-11H2,1H3
PubChem CID62705155
ChEMBLCHEMBL2057501
IUPHARN/A
BindingDB50387789
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
156Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460

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