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Ligand

NameCHEMBL2315933
Molecular formulaC25H28F3N7O
IUPAC nameN-[1-[4-(3-aminopyridin-2-yl)cyclohexyl]azetidin-3-yl]-2-[[6-(trifluoromethyl)quinazolin-4-yl]amino]acetamide
Molecular weight499.542
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogP3.3
SynonymsSCHEMBL9998962
BDBM50425694
CHEMBL3923056
SCHEMBL9998963
SCHEMBL15214578
[ Show all ]
Inchi KeyGEASWLLRXOGPGB-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H28F3N7O/c26-25(27,28)16-5-8-21-19(10-16)24(33-14-32-21)31-11-22(36)34-17-12-35(13-17)18-6-3-15(4-7-18)23-20(29)2-1-9-30-23/h1-2,5,8-10,14-15,17-18H,3-4,6-7,11-13,29H2,(H,34,36)(H,31,32,33)
PubChem CID54768835
ChEMBLCHEMBL3923056
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
538325C-C chemokine receptor-like 2O00421CCRL2Homo sapiens (Human)344

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