Chloroquine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1381
Total Number of Articles : 1964
PubChem 2719
Molecular Formula

C18H26ClN3

SMILES

CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl

InChI

InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)

synonyms
  • chloroquine
  • 54-05-7
  • Aralen
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Properties
Property Value
MW 319.9 g/mol
HBD 1
HBA 3
Rotatable Bond Count 8
Exact Mass 319.1815255 g/mol
Monoisotopic Mass 319.1815255 g/mol
Heavy Atom Count 22
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 309
xlogp 4.6
Topological Polar Surface Area 28.2