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canSAR19852
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NAMES
    SMILES
    C=C(c1ccc(C2CCCCC2)cc1)C1COC2(CCC(=C(C)C(=O)OCC)CC2)OO1
    InChI
    InChI=1S/C27H36O5/c1-4-29-26(28)20(3)22-14-16-27(17-15-22)30-18-25(31-32-27)19(2)21-10-12-24(13-11-21)23-8-6-5-7-9-23/h10-13,23,25H,2,4-9,14-18H2,1,3H3/b22-20-
    MOLECULAR FORMULA
    C27H36O5
    CROSS REFERENCES
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    canSAR19852

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.26
    AlogP 6.24
    HBond donors 0
    HBond acceptors 5
    Atoms 68
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR19852.