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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 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

NameMLS001116889
Molecular formulaC19H22N2O4S2
IUPAC name4-acetyl-N-[(4-methoxyphenyl)methyl]-2-methyl-2,3-dihydro-1,4-benzothiazine-6-sulfonamide
Molecular weight406.515
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.4
SynonymsHMS2926E07
CHEMBL1423899
SMR000627403
AKOS001932594
Inchi KeyACJLZUHRRMRWNT-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H22N2O4S2/c1-13-12-21(14(2)22)18-10-17(8-9-19(18)26-13)27(23,24)20-11-15-4-6-16(25-3)7-5-15/h4-10,13,20H,11-12H2,1-3H3
PubChem CID22550664
ChEMBLCHEMBL1423899
IUPHARN/A
BindingDBN/A
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
1634Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
463149Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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