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

NameSCHEMBL3498647
Molecular formulaC31H26ClN3O4
IUPAC name2-[[7-(4-chlorophenyl)imidazo[1,2-a]pyridine-2-carbonyl]amino]-3-[4-[(4-methylphenyl)methoxy]phenyl]propanoic acid
Molecular weight540.016
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP7.0
SynonymsCHEMBL3717422
Inchi KeySUGCTLMGWFHNMX-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H26ClN3O4/c1-20-2-4-22(5-3-20)19-39-26-12-6-21(7-13-26)16-27(31(37)38)34-30(36)28-18-35-15-14-24(17-29(35)33-28)23-8-10-25(32)11-9-23/h2-15,17-18,27H,16,19H2,1H3,(H,34,36)(H,37,38)
PubChem CID59335731
ChEMBLCHEMBL3717422
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
530656Probable G-protein coupled receptor 34Q9UPC5GPR34Homo sapiens (Human)381

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