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canSAR2083195
FEATURES
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NAMES
    SMILES
    Cc1ccc2c(c1)C1(C(=O)N2)C(C#N)=C(N)N2CC(C)(C)CNC2=C1[N+](=O)[O-]
    InChI
    InChI=1S/C19H20N6O3/c1-10-4-5-13-11(6-10)19(17(26)23-13)12(7-20)15(21)24-9-18(2,3)8-22-16(24)14(19)25(27)28/h4-6,22H,8-9,21H2,1-3H3,(H,23,26)
    MOLECULAR FORMULA
    C19H20N6O3
    CROSS REFERENCES
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    canSAR2083195

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.16
    AlogP 1.27
    HBond donors 4
    HBond acceptors 9
    Atoms 48
    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 canSAR2083195.