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

NameSCHEMBL3499664
Molecular formulaC32H27N3O4
IUPAC name2-[[6-[(E)-2-phenylethenyl]-1H-benzimidazole-2-carbonyl]amino]-3-(4-phenylmethoxyphenyl)propanoic acid
Molecular weight517.585
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP6.4
SynonymsSCHEMBL5270647
CHEMBL3718366
Inchi KeyQIJPKHCBKMSLCO-VAWYXSNFSA-N
Inchi IDInChI=1S/C32H27N3O4/c36-31(30-33-27-18-15-23(19-28(27)34-30)12-11-22-7-3-1-4-8-22)35-29(32(37)38)20-24-13-16-26(17-14-24)39-21-25-9-5-2-6-10-25/h1-19,29H,20-21H2,(H,33,34)(H,35,36)(H,37,38)/b12-11+
PubChem CID59335866
ChEMBLCHEMBL3718366
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
529442Probable G-protein coupled receptor 34Q9UPC5GPR34Homo sapiens (Human)381

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