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canSAR1126727
FEATURES
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NAMES
    SMILES
    C=C[C@@](C)(O)CCC1C(=C)C[C@H](OC(C)=O)C2C(C)(C)CCCC12C
    InChI
    InChI=1S/C22H36O3/c1-8-21(6,24)13-10-17-15(2)14-18(25-16(3)23)19-20(4,5)11-9-12-22(17,19)7/h8,17-19,24H,1-2,9-14H2,3-7H3/t17?,18-,19?,21+,22?/m0/s1
    MOLECULAR FORMULA
    C22H36O3
    CROSS REFERENCES
    1126727 logo

    canSAR1126727

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.27
    AlogP 5.04
    HBond donors 1
    HBond acceptors 3
    Atoms 61
    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 canSAR1126727.