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

NameCHEMBL609676
Molecular formulaC16H24N2O2
IUPAC nameN-[2-(dimethylamino)cyclohexyl]-4-hydroxy-N-methylbenzamide
Molecular weight276.38
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.4
SynonymsN/A
Inchi KeyAEXXPSTYDJTKJQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H24N2O2/c1-17(2)14-6-4-5-7-15(14)18(3)16(20)12-8-10-13(19)11-9-12/h8-11,14-15,19H,4-7H2,1-3H3
PubChem CID13544017
ChEMBLCHEMBL609676
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
3947Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398

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