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Ligand

NameCHEMBL3618195
Molecular formulaC19H17BrF4N2O
IUPAC name4-(4-bromophenyl)-N-[3-fluoro-5-(trifluoromethyl)phenyl]piperidine-1-carboxamide
Molecular weight445.256
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.0
SynonymsBDBM50120578
Inchi KeyDAFJKCOYEBEQOE-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H17BrF4N2O/c20-15-3-1-12(2-4-15)13-5-7-26(8-6-13)18(27)25-17-10-14(19(22,23)24)9-16(21)11-17/h1-4,9-11,13H,5-8H2,(H,25,27)
PubChem CID122190863
ChEMBLCHEMBL3618195
IUPHARN/A
BindingDB50120578
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
469717Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353

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