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canSAR1651540
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NAMES
    SMILES
    Oc1ccc(C2=COc3cc(O)c(CNCCc4ccccc4)cc3C2)cc1
    InChI
    InChI=1S/C24H23NO3/c26-22-8-6-18(7-9-22)21-13-19-12-20(23(27)14-24(19)28-16-21)15-25-11-10-17-4-2-1-3-5-17/h1-9,12,14,16,25-27H,10-11,13,15H2
    MOLECULAR FORMULA
    C24H23NO3
    CROSS REFERENCES
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    canSAR1651540

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 373.17
    AlogP 4.41
    HBond donors 3
    HBond acceptors 4
    Atoms 51
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1651540.