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canSAR985707
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NAMES
    SMILES
    O=[N+]([O-])c1cn2c(n1)OC[C@@H](NC(CCO)c1ccc(OC(F)(F)F)cc1)C2
    InChI
    InChI=1S/C16H17F3N4O5/c17-16(18,19)28-12-3-1-10(2-4-12)13(5-6-24)20-11-7-22-8-14(23(25)26)21-15(22)27-9-11/h1-4,8,11,13,20,24H,5-7,9H2/t11-,13?/m0/s1
    MOLECULAR FORMULA
    C16H17F3N4O5
    CROSS REFERENCES
    985707 logo

    canSAR985707

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.12
    AlogP 2.16
    HBond donors 2
    HBond acceptors 9
    Atoms 45
    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 canSAR985707.