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

NameAC1M7Z8S
Molecular formulaC15H14N4O5S
IUPAC name[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 4-(carbamoylamino)benzoate
Molecular weight362.36
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP0.7
Synonyms[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 4-(carbamoylamino)benzoate
MCULE-5369937045
SMR001238587
CHEMBL1590317
MLS002156075
[ Show all ]
Inchi KeyAFGAFCVNJKHVEM-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H14N4O5S/c16-12(21)10-5-6-25-13(10)19-11(20)7-24-14(22)8-1-3-9(4-2-8)18-15(17)23/h1-6H,7H2,(H2,16,21)(H,19,20)(H3,17,18,23)
PubChem CID2527277
ChEMBLCHEMBL1590317
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
4133Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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