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

NameAC1M7D1M
Molecular formulaC23H30N2O3
IUPAC name2-(2-benzylphenoxy)-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
Molecular weight382.504
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.4
Synonyms2-(2-benzylphenoxy)-N-[2-methyl-2-(morpholin-4-yl)propyl]acetamide
MLS000807236
ZINC25747686
HMS2700P23
SMR000376326
[ Show all ]
Inchi KeyABEICNDNLBOHDZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H30N2O3/c1-23(2,25-12-14-27-15-13-25)18-24-22(26)17-28-21-11-7-6-10-20(21)16-19-8-4-3-5-9-19/h3-11H,12-18H2,1-2H3,(H,24,26)
PubChem CID2439847
ChEMBLCHEMBL1464909
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
772Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
463045Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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