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Ligand

NameCHEMBL1689809
Molecular formulaC25H27F3N4O
IUPAC name7,7-dimethyl-5-phenyl-N-[2-[4-(trifluoromethyl)phenyl]propan-2-yl]-5,6-dihydro-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
Molecular weight456.513
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.0
SynonymsSCHEMBL13756461
BDBM50339323
7,7-Dimethyl-N-{1-methyl-1-[4-(trifluoromethyl)phenyl]ethyl}-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Inchi KeyASISRSAIVWZING-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H27F3N4O/c1-23(2)14-20(16-8-6-5-7-9-16)30-21-19(15-29-32(21)23)22(33)31-24(3,4)17-10-12-18(13-11-17)25(26,27)28/h5-13,15,20,30H,14H2,1-4H3,(H,31,33)
PubChem CID136030614
ChEMBLCHEMBL1689809
IUPHARN/A
BindingDB50339323
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
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GLASS IDNameUniProtGeneSpeciesLength
557653Extracellular calcium-sensing receptorP41180CASRHomo sapiens (Human)1078

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