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

NameCHEMBL1096811
Molecular formulaC19H16N2O2
IUPAC name2-(methoxymethoxy)-5-(2-methylquinolin-7-yl)benzonitrile
Molecular weight304.349
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.9
Synonyms2-Methoxymethoxy-5-(2-methylquinolin-7-yl)benzonitrile
BDBM50317845
Inchi KeyHOOMEXBDURPSJH-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H16N2O2/c1-13-3-4-14-5-6-16(10-18(14)21-13)15-7-8-19(23-12-22-2)17(9-15)11-20/h3-10H,12H2,1-2H3
PubChem CID46888004
ChEMBLCHEMBL1096811
IUPHARN/A
BindingDB50317845
DrugBankN/A

Structure

SDF download

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

Known GPCRs

You can:

Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
120200Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
120201Metabotropic glutamate receptor 2Q14416GRM2Homo sapiens (Human)872
120202Metabotropic glutamate receptor 4Q14833GRM4Homo sapiens (Human)912
120198Metabotropic glutamate receptor 5P31424Grm5Rattus norvegicus (Rat)1203
120199Metabotropic glutamate receptor 6O15303GRM6Homo sapiens (Human)877
120197Metabotropic glutamate receptor 8O00222GRM8Homo sapiens (Human)908

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