canSAR2080348
FEATURES
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NAMES
    SMILES
    O=C(NCc1ccccn1)c1nc2cc(C(F)(F)F)cc([N+](=O)[O-])c2s1
    InChI
    InChI=1S/C15H9F3N4O3S/c16-15(17,18)8-5-10-12(11(6-8)22(24)25)26-14(21-10)13(23)20-7-9-3-1-2-4-19-9/h1-6H,7H2,(H,20,23)
    MOLECULAR FORMULA
    C15H9F3N4O3S
    CROSS REFERENCES
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    canSAR2080348
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight382.03
    AlogP3.55
    HBond donors1
    HBond acceptors7
    Atoms35
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080348.