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

NameAC1MFNML
Molecular formulaC21H23ClN2O3S
IUPAC name2-[N-(benzenesulfonyl)-2-chloroanilino]-N-(2-bicyclo[2.2.1]heptanyl)acetamide
Molecular weight418.936
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.3
SynonymsCHEMBL2132915
SR-01000233775-1
2-[N-(benzenesulfonyl)-2-chloroanilino]-N-(3-bicyclo[2.2.1]heptanyl)acetamide
MolPort-002-198-651
AKOS022160872
[ Show all ]
Inchi KeyACRVJVLHVBOAMT-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H23ClN2O3S/c22-18-8-4-5-9-20(18)24(28(26,27)17-6-2-1-3-7-17)14-21(25)23-19-13-15-10-11-16(19)12-15/h1-9,15-16,19H,10-14H2,(H,23,25)
PubChem CID2897163
ChEMBLCHEMBL2132915
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
1855Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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