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canSAR1506826
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NAMES
    SMILES
    CCN(CC)c1ccc(C(=O)N2CCC(c3c[nH]c4ccccc34)(c3c[nH]c4ccccc34)CC2)cc1
    InChI
    InChI=1S/C32H34N4O/c1-3-35(4-2)24-15-13-23(14-16-24)31(37)36-19-17-32(18-20-36,27-21-33-29-11-7-5-9-25(27)29)28-22-34-30-12-8-6-10-26(28)30/h5-16,21-22,33-34H,3-4,17-20H2,1-2H3
    MOLECULAR FORMULA
    C32H34N4O
    CROSS REFERENCES
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    canSAR1506826

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 490.27
    AlogP 6.72
    HBond donors 2
    HBond acceptors 5
    Atoms 71
    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 canSAR1506826.