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canSAR389152
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NAMES
    SMILES
    C=C(C)CN1CCC23c4c5ccc(OC)c4O[C@H]2c2oc4ccccc4c2C[C@@]3(O)C1C5
    InChI
    InChI=1S/C27H27NO4/c1-15(2)14-28-11-10-26-22-16-8-9-20(30-3)24(22)32-25(26)23-18(13-27(26,29)21(28)12-16)17-6-4-5-7-19(17)31-23/h4-9,21,25,29H,1,10-14H2,2-3H3/t21?,25-,26?,27+/m0/s1
    MOLECULAR FORMULA
    C27H27NO4
    CROSS REFERENCES
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    canSAR389152

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.19
    AlogP 4.31
    HBond donors 1
    HBond acceptors 5
    Atoms 59
    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 canSAR389152.