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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL75380
Molecular formulaC10H16N2O2S
IUPAC name3-ethyl-8-methyl-2-sulfanylidene-1-oxa-3,8-diazaspiro[4.5]decan-4-one
Molecular weight228.31
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP1.1
Synonyms2-Thioxo-3-ethyl-8-methyl-1-oxa-3,8-diazaspiro[4.5]decan-4-one
BDBM50044702
3-Ethyl-8-methyl-2-thioxo-1-oxa-3,8-diaza-spiro[4.5]decan-4-one
Inchi KeyFGMFPQUYYBEYEK-UHFFFAOYSA-N
Inchi IDInChI=1S/C10H16N2O2S/c1-3-12-8(13)10(14-9(12)15)4-6-11(2)7-5-10/h3-7H2,1-2H3
PubChem CID14956867
ChEMBLCHEMBL75380
IUPHARN/A
BindingDB50044702
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
77893Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
77894Muscarinic acetylcholine receptor M2Q9ERZ4Chrm2Mus musculus (Mouse)466
77895Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466

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