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

NameMLS003119411
Molecular formulaC23H28FN3O3
IUPAC name5-[1-(cyclohexanecarbonyl)piperidin-2-yl]-N-[(4-fluorophenyl)methyl]-1,2-oxazole-3-carboxamide
Molecular weight413.493
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.9
SynonymsCHEMBL2138726
SMR001275381
Inchi KeyAAQBRUMKUJLJAZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H28FN3O3/c24-18-11-9-16(10-12-18)15-25-22(28)19-14-21(30-26-19)20-8-4-5-13-27(20)23(29)17-6-2-1-3-7-17/h9-12,14,17,20H,1-8,13,15H2,(H,25,28)
PubChem CID49790667
ChEMBLCHEMBL2138726
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
437Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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