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canSAR2049486
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NAMES
    SMILES
    Nc1nc(Nc2ccccc2)nc2c1cc(-c1c(Cl)cccc1Cl)c(=O)n2CCO
    InChI
    InChI=1S/C21H17Cl2N5O2/c22-15-7-4-8-16(23)17(15)13-11-14-18(24)26-21(25-12-5-2-1-3-6-12)27-19(14)28(9-10-29)20(13)30/h1-8,11,29H,9-10H2,(H3,24,25,26,27)
    MOLECULAR FORMULA
    C21H17Cl2N5O2
    CROSS REFERENCES
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    canSAR2049486

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.08
    AlogP 4.08
    HBond donors 4
    HBond acceptors 7
    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 canSAR2049486.