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canSAR1153758
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NAMES
    SMILES
    C#CCOc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CCCN1C3
    InChI
    InChI=1S/C25H25NO3/c1-4-10-29-17-7-8-18-20(12-17)22-14-25(28-3)24(27-2)13-21(22)19-11-16-6-5-9-26(16)15-23(18)19/h1,7-8,12-14,16H,5-6,9-11,15H2,2-3H3/t16-/m1/s1
    MOLECULAR FORMULA
    C25H25NO3
    CROSS REFERENCES
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    canSAR1153758

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 387.18
    AlogP 4.54
    HBond donors 0
    HBond acceptors 4
    Atoms 54
    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 canSAR1153758.