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canSAR1594809
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NAMES
    SMILES
    COCCn1nnnc1C(c1ccccn1)N1CCN(c2cc(Cl)ccc2C)CC1
    InChI
    InChI=1S/C21H26ClN7O/c1-16-6-7-17(22)15-19(16)27-9-11-28(12-10-27)20(18-5-3-4-8-23-18)21-24-25-26-29(21)13-14-30-2/h3-8,15,20H,9-14H2,1-2H3
    MOLECULAR FORMULA
    C21H26ClN7O
    CROSS REFERENCES
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    canSAR1594809

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.19
    AlogP 2.59
    HBond donors 0
    HBond acceptors 8
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1594809.