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canSAR1027417
FEATURES
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NAMES
    SMILES
    CC1=NN(C(=O)CN2CCCCC2[N+](=O)[O-])C(c2ccccc2O)C1
    InChI
    InChI=1S/C17H22N4O4/c1-12-10-14(13-6-2-3-7-15(13)22)20(18-12)17(23)11-19-9-5-4-8-16(19)21(24)25/h2-3,6-7,14,16,22H,4-5,8-11H2,1H3
    MOLECULAR FORMULA
    C17H22N4O4
    CROSS REFERENCES
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    canSAR1027417

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 346.16
    AlogP 2.13
    HBond donors 1
    HBond acceptors 8
    Atoms 47
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1027417.