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

Name4815-28-5
Molecular formulaC9H12N2OS
IUPAC name2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Molecular weight196.268
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP1.9
Synonyms2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
Benzo[b]thiophene-3-carboxamide, 2-amino-4,5,6,7-tetrahydro-
2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid amide
FFAKFORHXDNYEN-UHFFFAOYSA-N
[ Show all ]
Inchi KeyFFAKFORHXDNYEN-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H12N2OS/c10-8(12)7-5-3-1-2-4-6(5)13-9(7)11/h1-4,11H2,(H2,10,12)
PubChem CID290223
ChEMBLCHEMBL567508
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
76803Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212
76802Metabotropic glutamate receptor 6O15303GRM6Homo sapiens (Human)877

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