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Cantharidimide
FEATURES
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NAMES
  • CANTHARIDIMIDE
SMILES
C[C@]12C(=O)N(c3nc4ccc(OC(F)(F)F)cc4s3)C(=O)[C@@]1(C)[C@@H]1CC[C@H]2O1
InChI
InChI=1S/C18H15F3N2O4S/c1-16-11-5-6-12(26-11)17(16,2)14(25)23(13(16)24)15-22-9-4-3-8(7-10(9)28-15)27-18(19,20)21/h3-4,7,11-12H,5-6H2,1-2H3/t11-,12+,16+,17-
MOLECULAR FORMULA
C18H15F3N2O4S
CROSS REFERENCES
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Cantharidimide

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 412.07
AlogP 3.64
HBond donors 0
HBond acceptors 6
Atoms 43
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 Cantharidimide.