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canSAR200362
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NAMES
    SMILES
    Cc1cc(=O)n(C2CCCC2)c2nc(Nc3ccc(N4CCNCC4)c(Cl)c3)ncc12
    InChI
    InChI=1S/C23H27ClN6O/c1-15-12-21(31)30(17-4-2-3-5-17)22-18(15)14-26-23(28-22)27-16-6-7-20(19(24)13-16)29-10-8-25-9-11-29/h6-7,12-14,17,25H,2-5,8-11H2,1H3,(H,26,27,28)
    MOLECULAR FORMULA
    C23H27ClN6O
    CROSS REFERENCES
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    canSAR200362

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.19
    AlogP 4.02
    HBond donors 2
    HBond acceptors 7
    Atoms 58
    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 canSAR200362.