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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 ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL2431115
Molecular formulaC23H28N4O3
IUPAC name2-ethyl-6,7-dimethoxy-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinazoline
Molecular weight408.502
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.3
SynonymsSCHEMBL15818947
BDBM50440753
MLS-0471479.0001
2-ethyl-6,7-dimethoxy-4-(4-(2-methoxyphenyl)piperazin-1-yl)quinazoline
PDEAKHQWPNWDTL-UHFFFAOYSA-N
Inchi KeyPDEAKHQWPNWDTL-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H28N4O3/c1-5-22-24-17-15-21(30-4)20(29-3)14-16(17)23(25-22)27-12-10-26(11-13-27)18-8-6-7-9-19(18)28-2/h6-9,14-15H,5,10-13H2,1-4H3
PubChem CID56593293
ChEMBLCHEMBL2431115
IUPHARN/A
BindingDB50440753
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
256847G-protein coupled receptor 35Q9HC97GPR35Homo sapiens (Human)309
256845Neurotensin receptor type 1P30989NTSR1Homo sapiens (Human)418
256846Neurotensin receptor type 2O95665NTSR2Homo sapiens (Human)410

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