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

I-TASSER I-TASSER-MTD C-I-TASSER CR-I-TASSER QUARK C-QUARK LOMETS MUSTER CEthreader SEGMER DeepFold DeepFoldRNA FoldDesign COFACTOR COACH MetaGO TripletGO IonCom FG-MD ModRefiner REMO DEMO DEMO-EM DMFold SPRING COTH Threpp PEPPI BSpred ANGLOR EDock BSP-SLIM SAXSTER FUpred ThreaDom ThreaDomEx EvoDesign BindProf BindProfX SSIPe GPCR-I-TASSER MAGELLAN ResQ STRUM DAMpred

TM-score TM-align US-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 TripletRes DeepPotential WDL-RF ATPbind DockRMSD DeepMSA FASPR EM-Refiner GPU-I-TASSER

BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

You can:

Ligand

NameCHEMBL1774884
Molecular formulaC23H16O3
IUPAC name7-phenoxy-4-phenylnaphthalene-2-carboxylic acid
Molecular weight340.378
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.9
SynonymsBDBM50343869
7-phenoxy-4-phenyl-2-naphthoic acid
Inchi KeyZGPCPCXGKKJJBA-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H16O3/c24-23(25)18-13-17-14-20(26-19-9-5-2-6-10-19)11-12-21(17)22(15-18)16-7-3-1-4-8-16/h1-15H,(H,24,25)
PubChem CID54581993
ChEMBLCHEMBL1774884
IUPHARN/A
BindingDB50343869
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
428041P2Y purinoceptor 14Q9ESG6P2ry14Mus musculus (Mouse)338

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