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Ligand

NameCHEMBL1209477
Molecular formulaC26H33FN2O2S
IUPAC name[(E)-(1,2-dicyclohexyl-3-thiophen-2-ylpropylidene)amino] N-(3-fluorophenyl)carbamate
Molecular weight456.62
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP8.3
SynonymsBDBM50323379
(1,2-dicyclohexyl-3-(6-thioxocyclohexa-1,3-dienyl)propylideneaminooxy)(3-fluorophenylamino)methanone
Inchi KeyAGZVOJFYAHTCLL-XLVZBRSZSA-N
Inchi IDInChI=1S/C26H33FN2O2S/c27-21-13-7-14-22(17-21)28-26(30)31-29-25(20-11-5-2-6-12-20)24(18-23-15-8-16-32-23)19-9-3-1-4-10-19/h7-8,13-17,19-20,24H,1-6,9-12,18H2,(H,28,30)/b29-25+
PubChem CID49862489
ChEMBLCHEMBL1209477
IUPHARN/A
BindingDB50323379
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
5369Metabotropic glutamate receptor 5P31424Grm5Rattus norvegicus (Rat)1203

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