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canSAR834584
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NAMES
    SMILES
    C[C@H]1OC(=O)[C@@H]2C=C3CCCC[C@H]3[C@H](/C=C/c3ccc(-c4ccccc4)cn3)[C@H]12
    InChI
    InChI=1S/C26H27NO2/c1-17-25-23(22-10-6-5-9-19(22)15-24(25)26(28)29-17)14-13-21-12-11-20(16-27-21)18-7-3-2-4-8-18/h2-4,7-8,11-17,22-25H,5-6,9-10H2,1H3/b14-13+/t17-,22-,23+,24-,25+/m1/s1
    MOLECULAR FORMULA
    C26H27NO2
    CROSS REFERENCES
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    canSAR834584

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.20
    AlogP 5.69
    HBond donors 0
    HBond acceptors 3
    Atoms 56
    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 canSAR834584.