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canSAR1154894
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NAMES
    SMILES
    COc1cc(C2CC(c3ccc([N+](=O)[O-])cc3)=NC(=O)N2)cc(OC)c1OC
    InChI
    InChI=1S/C19H19N3O6/c1-26-16-8-12(9-17(27-2)18(16)28-3)15-10-14(20-19(23)21-15)11-4-6-13(7-5-11)22(24)25/h4-9,15H,10H2,1-3H3,(H,21,23)
    MOLECULAR FORMULA
    C19H19N3O6
    CROSS REFERENCES
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    canSAR1154894

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.13
    AlogP 3.26
    HBond donors 1
    HBond acceptors 9
    Atoms 47
    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 canSAR1154894.