pimodivir

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 2
Total Number of Articles : 2
PubChem 67286591
Molecular Formula

C20H19F2N5O2

SMILES

C1CC2CCC1[C@@H]([C@H]2NC3=NC(=NC=C3F)C4=CNC5=C4C=C(C=N5)F)C(=O)O

InChI

InChI=1S/C20H19F2N5O2/c21-11-5-12-13(7-24-17(12)23-6-11)18-25-8-14(22)19(27-18)26-16-10-3-1-9(2-4-10)15(16)20(28)29/h5-10,15-16H,1-4H2,(H,23,24)(H,28,29)(H,25,26,27)/t9?,10?,15-,16-/m0/s1

synonyms
  • Pimodivir
  • 1629869-44-8
  • VX-787
Click to show/hide the synonyms
Properties
Property Value
MW 399.4 g/mol
HBD 3
HBA 8
Rotatable Bond Count 4
Exact Mass 399.15068119 g/mol
Monoisotopic Mass 399.15068119 g/mol
Heavy Atom Count 29
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 620
xlogp 3.8
Topological Polar Surface Area 104