XL765

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 10
Total Number of Articles : 13
PubChem 49867926
Molecular Formula

C31H29N5O6S

SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC4=CC=CC=C4N=C3NC5=CC(=CC(=C5)OC)OC)OC

InChI

InChI=1S/C31H29N5O6S/c1-19-9-10-20(15-28(19)42-4)31(37)33-21-11-13-25(14-12-21)43(38,39)36-30-29(34-26-7-5-6-8-27(26)35-30)32-22-16-23(40-2)18-24(17-22)41-3/h5-18H,1-4H3,(H,32,34)(H,33,37)(H,35,36)

synonyms
  • 1349796-36-6
  • XL765
  • 1123889-87-1
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Properties
Property Value
MW 599.7 g/mol
HBD 3
HBA 10
Rotatable Bond Count 10
Exact Mass 599.18385484 g/mol
Monoisotopic Mass 599.18385484 g/mol
Heavy Atom Count 43
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 993
xlogp 5.1
Topological Polar Surface Area 149