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2KF
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NAMES
  • 2KF
SMILES
CCOc1cc(C(Nc2ccc3c(N)nccc3c2)C(=O)NCc2ccccc2S(=O)(=O)C(C)C)ccc1OC(C)C
InChI
InChI=1S/C32H38N4O5S/c1-6-40-28-18-23(11-14-27(28)41-20(2)3)30(36-25-12-13-26-22(17-25)15-16-34-31(26)33)32(37)35-19-24-9-7-8-10-29(24)42(38,39)21(4)5/h7-18,20-21,30,36H,6,19H2,1-5H3,(H2,33,34)(H,35,37)/t30-/m1/s1
MOLECULAR FORMULA
C32H38N4O5S
CROSS REFERENCES
  • UniChem: 68940386
  • canSAR: 1148174
  • PDBe (Protein Data Bank Europe): 2KF
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2KF

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 590.26
AlogP 5.65
HBond donors 4
HBond acceptors 9
Atoms 80
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 2KF.