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Ligand

NameCHEMBL3670940
Molecular formulaC26H34N6O
IUPAC name2-amino-1-[4-[(E)-3-[4-[(2-ethyl-5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methyl]phenyl]prop-2-enyl]piperazin-1-yl]ethanone
Molecular weight446.599
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.7
SynonymsSCHEMBL12802570
US8748435, 11
BDBM123486
SCHEMBL12802568
Inchi KeyPBLJKGCDUKLIGP-AATRIKPKSA-N
Inchi IDInChI=1S/C26H34N6O/c1-4-24-23(26-28-19(2)16-20(3)32(26)29-24)17-22-9-7-21(8-10-22)6-5-11-30-12-14-31(15-13-30)25(33)18-27/h5-10,16H,4,11-15,17-18,27H2,1-3H3/b6-5+
PubChem CID68378943
ChEMBLCHEMBL3670940
IUPHARN/A
BindingDB123486
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
255698G-protein coupled receptor 4P46093GPR4Homo sapiens (Human)362

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