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canSAR1121470
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NAMES
    SMILES
    Nc1ccc(CCCCc2nc(N)nc(N)c2-c2ccc(Cl)c(Cl)c2)cc1
    InChI
    InChI=1S/C20H21Cl2N5/c21-15-10-7-13(11-16(15)22)18-17(26-20(25)27-19(18)24)4-2-1-3-12-5-8-14(23)9-6-12/h5-11H,1-4,23H2,(H4,24,25,26,27)
    MOLECULAR FORMULA
    C20H21Cl2N5
    CROSS REFERENCES
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    canSAR1121470

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.12
    AlogP 4.76
    HBond donors 6
    HBond acceptors 5
    Atoms 48
    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 canSAR1121470.