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

Name4-({4-[(4-benzyl-1-piperidinyl)carbonothioyl]phenoxy}acetyl)morpholine
Molecular formulaC25H30N2O3S
IUPAC name2-[4-(4-benzylpiperidine-1-carbothioyl)phenoxy]-1-morpholin-4-ylethanone
Molecular weight438.586
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.8
SynonymsAC1MG7QK
MLS000621342
CHEMBL1714454
MolPort-002-270-793
HMS2688L17
[ Show all ]
Inchi KeyAEAZKGOLVAGODE-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H30N2O3S/c28-24(26-14-16-29-17-15-26)19-30-23-8-6-22(7-9-23)25(31)27-12-10-21(11-13-27)18-20-4-2-1-3-5-20/h1-9,21H,10-19H2
PubChem CID2956823
ChEMBLCHEMBL1714454
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
3286Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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