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XA0
FEATURES
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NAMES
  • XA0
SMILES
NC(=O)c1cc([N+](=O)[O-])c(Cl)cc1NCc1cc(F)c(F)c(F)c1
InChI
InChI=1S/C14H9ClF3N3O3/c15-8-4-11(7(14(19)22)3-12(8)21(23)24)20-5-6-1-9(16)13(18)10(17)2-6/h1-4,20H,5H2,(H2,19,22)
MOLECULAR FORMULA
C14H9ClF3N3O3
CROSS REFERENCES
  • UniChem: 27265449
  • canSAR: 1016759
  • PDBe (Protein Data Bank Europe): XA0
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XA0

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 359.03
AlogP 3.38
HBond donors 3
HBond acceptors 6
Atoms 33
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 XA0.