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Ligand

NameCHEMBL2181442
Molecular formulaC25H31BrN+
IUPAC name[4-(2-bromophenyl)phenyl]methyl-[[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methyl]-dimethylazanium
Molecular weight425.434
Hydrogen bond acceptor0
Hydrogen bond donor0
XlogP6.1
SynonymsCHEMBL2220409
BDBM50399983
ZINC95564651
Inchi KeyBDKXRZBYASMPGB-GMAHTHKFSA-N
Inchi IDInChI=1S/C25H31BrN/c1-25(2)21-14-13-20(23(25)15-21)17-27(3,4)16-18-9-11-19(12-10-18)22-7-5-6-8-24(22)26/h5-13,21,23H,14-17H2,1-4H3/q+1/t21-,23-/m0/s1
PubChem CID71459295
ChEMBLN/A
IUPHARN/A
BindingDB50399983
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
21034C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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