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Ligand

NameCHEMBL10015
Molecular formulaC23H24BrF3N4O
IUPAC name2-bromo-1-N-ethyl-6-methoxy-4-N,4-N-dimethyl-1-N-[4-methyl-6-[2-(trifluoromethyl)phenyl]pyrimidin-2-yl]benzene-1,4-diamine
Molecular weight509.371
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP6.3
SynonymsSCHEMBL8208578
BDBM50076758
2-Bromo-N*1*-ethyl-6-methoxy-N*4*,N*4*-dimethyl-N*1*-[4-methyl-6-(2-trifluoromethyl-phenyl)-pyrimidin-2-yl]-benzene-1,4-diamine
Inchi KeyASPGWFIMJWAWGW-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H24BrF3N4O/c1-6-31(21-18(24)12-15(30(3)4)13-20(21)32-5)22-28-14(2)11-19(29-22)16-9-7-8-10-17(16)23(25,26)27/h7-13H,6H2,1-5H3
PubChem CID18691325
ChEMBLCHEMBL10015
IUPHARN/A
BindingDB50076758
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
13409Corticotropin-releasing factor receptor 1P34998CRHR1Homo sapiens (Human)444

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