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

NameCHEMBL577710
Molecular formulaC17H20N2O3S
IUPAC nameethyl 2-(ethylcarbamoylamino)-4-methyl-5-phenylthiophene-3-carboxylate
Molecular weight332.418
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.1
SynonymsN/A
Inchi KeyJZBQZURGKAJNRZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H20N2O3S/c1-4-18-17(21)19-15-13(16(20)22-5-2)11(3)14(23-15)12-9-7-6-8-10-12/h6-10H,4-5H2,1-3H3,(H2,18,19,21)
PubChem CID44817660
ChEMBLCHEMBL577710
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
163553Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212
163552Metabotropic glutamate receptor 6O15303GRM6Homo sapiens (Human)877

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