Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only
Online Services

I-TASSER QUARK LOMETS COACH COFACTOR MetaGO MUSTER CEthreader SEGMER FG-MD ModRefiner REMO DEMO SPRING COTH BSpred ANGLOR EDock BSP-SLIM SAXSTER FUpred ThreaDom ThreaDomEx EvoDesign GPCR-I-TASSER MAGELLAN BindProf BindProfX SSIPe 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 SVMSEQ NeBcon ResPRE WDL-RF ATPbind DockRMSD DeepMSA FASPR

BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

You can:

Ligand

NameCHEMBL576121
Molecular formulaC16H13N3OS
IUPAC nameN-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide
Molecular weight295.36
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP2.9
SynonymsBDBM50301527
N-methyl-N-(4-(pyridin-4-yl)thiazol-2-yl)benzamide
Inchi KeyAHHXPJLZHPSYLT-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H13N3OS/c1-19(15(20)13-5-3-2-4-6-13)16-18-14(11-21-16)12-7-9-17-10-8-12/h2-11H,1H3
PubChem CID16661406
ChEMBLCHEMBL576121
IUPHARN/A
BindingDB50301527
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
5563Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194

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