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X65
FEATURES
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NAMES
  • X65
SMILES
NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(S(N)(=O)=O)cc1
InChI
InChI=1S/C14H14N4O5S/c15-14(19)12-7-10(18(20)21)3-6-13(12)17-8-9-1-4-11(5-2-9)24(16,22)23/h1-7,17H,8H2,(H2,15,19)(H2,16,22,23)
MOLECULAR FORMULA
C14H14N4O5S
CROSS REFERENCES
  • UniChem: 27265417
  • canSAR: 1017425
  • PDBe (Protein Data Bank Europe): X65
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X65

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 350.07
AlogP 0.95
HBond donors 5
HBond acceptors 9
Atoms 38
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 X65.