dapt

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 486
Total Number of Articles : 622
PubChem 5311272
Molecular Formula

C23H26F2N2O4

SMILES

C[C@@H](C(=O)N[C@@H](C1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)CC2=CC(=CC(=C2)F)F

InChI

InChI=1S/C23H26F2N2O4/c1-14(26-19(28)12-15-10-17(24)13-18(25)11-15)21(29)27-20(16-8-6-5-7-9-16)22(30)31-23(2,3)4/h5-11,13-14,20H,12H2,1-4H3,(H,26,28)(H,27,29)/t14-,20-/m0/s1

synonyms
  • dapt
  • 208255-80-5
  • DAPT (GSI-IX)
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Properties
Property Value
MW 432.5 g/mol
HBD 2
HBA 6
Rotatable Bond Count 9
Exact Mass 432.18606364 g/mol
Monoisotopic Mass 432.18606364 g/mol
Heavy Atom Count 31
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 622
xlogp 3.7
Topological Polar Surface Area 84.5