Pentamidine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 143
Total Number of Articles : 160
PubChem 4735
Molecular Formula

C19H24N4O2

SMILES

C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H24N4O2/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23)

synonyms
  • pentamidine
  • 100-33-4
  • 4,4'-(Pentane-1,5-diylbis(oxy))dibenzimidamide
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Properties
Property Value
MW 340.4 g/mol
HBD 4
HBA 4
Rotatable Bond Count 10
Exact Mass 340.18992602 g/mol
Monoisotopic Mass 340.18992602 g/mol
Heavy Atom Count 25
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 376
xlogp 2.6
Topological Polar Surface Area 118