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

NameCHEMBL469519
Molecular formulaC17H14O3
IUPAC name3-benzyl-8-methoxychromen-2-one
Molecular weight266.296
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.8
Synonyms3-benzyl-8-methoxychromen-2-one
3-benzyl-8-methoxy-2H-chromen-2-one
BDBM50434893
Inchi KeyBLDPWZKMVHRYSQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H14O3/c1-19-15-9-5-8-13-11-14(17(18)20-16(13)15)10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3
PubChem CID14417955
ChEMBLCHEMBL469519
IUPHARN/A
BindingDB50434893
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
26445Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473
26443Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
26444G-protein coupled receptor 55Q9Y2T6GPR55Homo sapiens (Human)319

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