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canSAR668733
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NAMES
    SMILES
    Nc1n[nH]c2nc(N3CCCCC3)c3c(c12)CCN(Cc1ccccc1)C3
    InChI
    InChI=1S/C21H26N6/c22-19-18-16-9-12-26(13-15-7-3-1-4-8-15)14-17(16)21(23-20(18)25-24-19)27-10-5-2-6-11-27/h1,3-4,7-8H,2,5-6,9-14H2,(H3,22,23,24,25)
    MOLECULAR FORMULA
    C21H26N6
    CROSS REFERENCES
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    canSAR668733

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 362.22
    AlogP 3.09
    HBond donors 3
    HBond acceptors 6
    Atoms 53
    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 canSAR668733.