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canSAR648824
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NAMES
    SMILES
    Oc1cccc(-c2nc(N3CCOCC3)c3ncn(C4CCN(Cc5cncc(Cl)c5)CC4)c3n2)c1
    InChI
    InChI=1S/C26H28ClN7O2/c27-20-12-18(14-28-15-20)16-32-6-4-21(5-7-32)34-17-29-23-25(33-8-10-36-11-9-33)30-24(31-26(23)34)19-2-1-3-22(35)13-19/h1-3,12-15,17,21,35H,4-11,16H2
    MOLECULAR FORMULA
    C26H28ClN7O2
    CROSS REFERENCES
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    canSAR648824

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 505.20
    AlogP 3.92
    HBond donors 1
    HBond acceptors 9
    Atoms 64
    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 canSAR648824.