Home Research Services Publications People Teaching Job Opening Facilities News Forum Lab Only
Online Services

I-TASSER QUARK LOMETS COACH COFACTOR MetaGO MUSTER SEGMER FG-MD ModRefiner REMO DEMO SPRING COTH BSpred SVMSEQ ANGLOR BSP-SLIM SAXSTER ThreaDom ThreaDomEx EvoDesign GPCR-I-TASSER BindProf BindProfX ResQ IonCom STRUM DAMpred

TM-score TM-align MM-align RNA-align NW-align LS-align EDTSurf MVP MVP-Fit SPICKER HAAD PSSpred 3DRobot MR-REX I-TASSER-MR NeBcon WDL-RF ATPbind DockRMSD

BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP TM-fold DECOYS POTENTIAL RW/RWplus HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

You can:

Ligand

NameCHEMBL1354533
Molecular formulaC22H26N2O3S
IUPAC name1-(cyclobutanecarbonyl)-N-(2,3-dimethylphenyl)-3,4-dihydro-2H-quinoline-6-sulfonamide
Molecular weight398.521
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.9
SynonymsMolPort-007-888-735
HMS1901O01
ZINC8601020
AKOS002042097
MCULE-1582886143
[ Show all ]
Inchi KeyAAALVBIWOWZUBR-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H26N2O3S/c1-15-6-3-10-20(16(15)2)23-28(26,27)19-11-12-21-18(14-19)9-5-13-24(21)22(25)17-7-4-8-17/h3,6,10-12,14,17,23H,4-5,7-9,13H2,1-2H3
PubChem CID16031807
ChEMBLCHEMBL1354533
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
9Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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