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

NameMLS001166970
Molecular formulaC23H29N3O7S
IUPAC nameN'-[[3-(4-methoxy-3-methylphenyl)sulfonyl-1,3-oxazolidin-2-yl]methyl]-N-[2-(2-methoxyphenyl)ethyl]oxamide
Molecular weight491.559
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP2.1
SynonymsCHEMBL1730884
MolPort-003-078-830
HMS2241F05
AKOS024614130
MCULE-2873690552
[ Show all ]
Inchi KeyAEDKOIOEFUTGRT-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H29N3O7S/c1-16-14-18(8-9-19(16)31-2)34(29,30)26-12-13-33-21(26)15-25-23(28)22(27)24-11-10-17-6-4-5-7-20(17)32-3/h4-9,14,21H,10-13,15H2,1-3H3,(H,24,27)(H,25,28)
PubChem CID16825558
ChEMBLCHEMBL1730884
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3365Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
463286Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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