canSAR632870
FEATURES
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NAMES
    SMILES
    COc1ccc2c3c1O[C@@H]1C4(OC)CCC5(CC4C(C)(O)C(C)(C)C)[C@H](C2)NCC[C@@]315
    InChI
    InChI=1S/C26H37NO4/c1-22(2,3)23(4,28)17-14-24-9-10-26(17,30-6)21-25(24)11-12-27-18(24)13-15-7-8-16(29-5)20(31-21)19(15)25/h7-8,17-18,21,27-28H,9-14H2,1-6H3/t17?,18-,21-,23?,24?,25+,26?/m0/s1
    MOLECULAR FORMULA
    C26H37NO4
    CROSS REFERENCES
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    canSAR632870
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight427.27
    AlogP3.59
    HBond donors2
    HBond acceptors5
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR632870.