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Auranofin Analogue
FEATURES
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NAMES
  • Auranofin analogue
SMILES
CC(=O)OCC1OC(S[Au-2][PH](C(C)C)(C(C)C)C(C)C)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
InChI
InChI=1S/C14H20O9S.C9H21P.Au/c1-6(15)19-5-10-11(20-7(2)16)12(21-8(3)17)13(14(24)23-10)22-9(4)18;1-7(2)10(8(3)4)9(5)6;/h10-14,24H,5H2,1-4H3;7-9H,1-6H3;/q;;-2
MOLECULAR FORMULA
C23H41AuO9PS-2
CROSS REFERENCES
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Auranofin Analogue

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 721.19
AlogP 3.69
HBond donors 0
HBond acceptors 9
Atoms 76
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Auranofin Analogue.