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 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

NameR-dimethindene
Molecular formulaC20H24N2
IUPAC nameN,N-dimethyl-2-[3-[(1R)-1-pyridin-2-ylethyl]-1H-inden-2-yl]ethanamine
Molecular weight292.426
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP2.7
Synonyms(R)-Dimethindene
CHEMBL564226
1H-Indene-2-ethanamine, N,N-dimethyl-3-(1-(2-pyridinyl)ethyl)-, (R)-
(?)-Dimethindene
C9Z23T6963
[ Show all ]
Inchi KeyMVMQESMQSYOVGV-HNNXBMFYSA-N
Inchi IDInChI=1S/C20H24N2/c1-15(19-10-6-7-12-21-19)20-17(11-13-22(2)3)14-16-8-4-5-9-18(16)20/h4-10,12,15H,11,13-14H2,1-3H3/t15-/m0/s1
PubChem CID12963076
ChEMBLCHEMBL564226
IUPHARN/A
BindingDB50297307
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Total entries: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2151685-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
215164Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
215165Muscarinic acetylcholine receptor DM1P16395mAChR-ADrosophila melanogaster (Fruit fly)805
215166Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
215169Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
215171Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
215167Muscarinic acetylcholine receptor M4P08173CHRM4Homo sapiens (Human)479
215170Muscarinic acetylcholine receptor M5P08912CHRM5Homo sapiens (Human)532

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