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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

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Ligand

NameCHEMBL1514567
Molecular formulaC21H18N2O2S
IUPAC name7-[(3,5-dimethylphenoxy)methyl]-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Molecular weight362.447
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.0
SynonymsMolPort-007-655-501
HMS1832H06
ZINC8603537
CCG-67593
AKOS001842284
[ Show all ]
Inchi KeyAMCCNXBMIGGOCJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H18N2O2S/c1-14-8-15(2)10-18(9-14)25-12-17-11-20(24)23-19(13-26-21(23)22-17)16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3
PubChem CID16009347
ChEMBLCHEMBL1514567
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463936Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
8736Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757

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