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Ligand

NameCHEMBL3701903
Molecular formulaC21H24ClF3N2
IUPAC nameN-[1-(4-chlorophenyl)-2,2,2-trifluoroethyl]-4-(2-piperidin-3-ylethyl)aniline
Molecular weight396.882
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP6.1
SynonymsUS8802673, 4
BDBM129362
SCHEMBL12609930
Inchi KeyBEOYESMOQLVWGJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H24ClF3N2/c22-18-9-7-17(8-10-18)20(21(23,24)25)27-19-11-5-15(6-12-19)3-4-16-2-1-13-26-14-16/h5-12,16,20,26-27H,1-4,13-14H2
PubChem CID68325662
ChEMBLCHEMBL3701903
IUPHARN/A
BindingDB129362
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
21773Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332
21772Trace amine-associated receptor 7bQ923X8Taar7bRattus norvegicus (Rat)358

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