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I-TASSER I-TASSER-MTD C-I-TASSER CR-I-TASSER QUARK C-QUARK LOMETS MUSTER CEthreader SEGMER DeepFold DeepFoldRNA FoldDesign COFACTOR COACH MetaGO TripletGO IonCom FG-MD ModRefiner REMO DEMO DEMO-EM DMFold SPRING COTH Threpp PEPPI BSpred ANGLOR EDock BSP-SLIM SAXSTER FUpred ThreaDom ThreaDomEx EvoDesign BindProf BindProfX SSIPe GPCR-I-TASSER MAGELLAN ResQ STRUM DAMpred

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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

NameCHEMBL25649
Molecular formulaC9H15N2O2+
IUPAC name3-methoxy-5,5-dimethyl-6,7-dihydro-4H-[1,2]oxazolo[4,5-c]pyridin-5-ium
Molecular weight183.231
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP0.4
Synonyms3-Methoxy-5,5-dimethyl-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyridin-5-ium; iodide
CHEMBL1178388
BDBM50023699
Inchi KeyBSGKWQAJXQPUTE-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H15N2O2/c1-11(2)5-4-8-7(6-11)9(12-3)10-13-8/h4-6H2,1-3H3/q+1
PubChem CID14058518
ChEMBLN/A
IUPHARN/A
BindingDB50023699
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
31636Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
31635Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466

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