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canSAR1151096
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NAMES
    SMILES
    OCCNCC(O)(Cn1cncn1)c1ccc(Oc2ccc(Cl)cc2)cc1Cl
    InChI
    InChI=1S/C19H20Cl2N4O3/c20-14-1-3-15(4-2-14)28-16-5-6-17(18(21)9-16)19(27,10-22-7-8-26)11-25-13-23-12-24-25/h1-6,9,12-13,22,26-27H,7-8,10-11H2
    MOLECULAR FORMULA
    C19H20Cl2N4O3
    CROSS REFERENCES
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    canSAR1151096

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 422.09
    AlogP 2.85
    HBond donors 3
    HBond acceptors 7
    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 canSAR1151096.