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Ligand

NameCHEMBL1802280
Molecular formulaC18H16F2N4
IUPAC name5-fluoro-N-[[4-[[(5-fluoropyridin-2-yl)amino]methyl]phenyl]methyl]pyridin-2-amine
Molecular weight326.351
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.6
SynonymsSCHEMBL10055036
Inchi KeyCROONFRXAQIKIS-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H16F2N4/c19-15-5-7-17(23-11-15)21-9-13-1-2-14(4-3-13)10-22-18-8-6-16(20)12-24-18/h1-8,11-12H,9-10H2,(H,21,23)(H,22,24)
PubChem CID49857285
ChEMBLCHEMBL1802280
IUPHARN/A
BindingDBN/A
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
48968C-X-C chemokine receptor type 4P61073CXCR4Homo sapiens (Human)352

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