Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only
Online Services

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

TM-score TM-align US-align MM-align RNA-align NW-align LS-align EDTSurf MVP MVP-Fit SPICKER HAAD PSSpred 3DRobot MR-REX I-TASSER-MR SVMSEQ NeBcon ResPRE TripletRes DeepPotential WDL-RF ATPbind DockRMSD DeepMSA FASPR EM-Refiner GPU-I-TASSER

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

You can:

Ligand

NameMLS002165899
Molecular formulaC18H16N2O5
IUPAC name[2-(2,4-dimethoxyphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate
Molecular weight340.335
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.1
Synonyms2-(2,4-dimethoxyphenyl)-2-oxoethyl 1H-indazole-3-carboxylate
HMS3016I09
[2-(2,4-dimethoxyphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate
AKOS033630456
MolPort-005-322-469
[ Show all ]
Inchi KeyACYGHEFMPUDNNP-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H16N2O5/c1-23-11-7-8-13(16(9-11)24-2)15(21)10-25-18(22)17-12-5-3-4-6-14(12)19-20-17/h3-9H,10H2,1-2H3,(H,19,20)
PubChem CID2638058
ChEMBLCHEMBL1475285
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2029Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218