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Ligand

NameCHEMBL2205078
Molecular formulaC26H33N2+
IUPAC name[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methyl-dimethyl-[(9-methylcarbazol-2-yl)methyl]azanium
Molecular weight373.564
Hydrogen bond acceptor0
Hydrogen bond donor0
XlogP5.2
SynonymsBDBM50400929
CHEMBL2220059
Inchi KeyADJZEARNEOEAPU-REWPJTCUSA-N
Inchi IDInChI=1S/C26H33N2/c1-26(2)20-12-11-19(23(26)15-20)17-28(4,5)16-18-10-13-22-21-8-6-7-9-24(21)27(3)25(22)14-18/h6-11,13-14,20,23H,12,15-17H2,1-5H3/q+1/t20-,23-/m0/s1
PubChem CID71452316
ChEMBLN/A
IUPHARN/A
BindingDB50400929
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
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GLASS IDNameUniProtGeneSpeciesLength
2373C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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