ruboxistaurin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 85
Total Number of Articles : 133
PubChem 153999
Molecular Formula

C28H28N4O3

SMILES

CN(C)C[C@@H]1CCN2C=C(C3=CC=CC=C32)C4=C(C5=CN(CCO1)C6=CC=CC=C65)C(=O)NC4=O

InChI

InChI=1S/C28H28N4O3/c1-30(2)15-18-11-12-31-16-21(19-7-3-5-9-23(19)31)25-26(28(34)29-27(25)33)22-17-32(13-14-35-18)24-10-6-4-8-20(22)24/h3-10,16-18H,11-15H2,1-2H3,(H,29,33,34)/t18-/m0/s1

synonyms
  • Ruboxistaurin
  • 169939-94-0
  • LY-333531
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Properties
Property Value
MW 468.5 g/mol
HBD 1
HBA 4
Rotatable Bond Count 2
Exact Mass 468.21614077 g/mol
Monoisotopic Mass 468.21614077 g/mol
Heavy Atom Count 35
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 872
xlogp 2.7
Topological Polar Surface Area 68.5