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canSAR833777
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NAMES
    SMILES
    C[C@]12CCC(=O)C[C@@H]1CCC1C2CC[C@@]2(C)C1CC[C@@]2(O)C#CCCBr
    InChI
    InChI=1S/C23H33BrO2/c1-21-11-7-17(25)15-16(21)5-6-18-19(21)8-12-22(2)20(18)9-13-23(22,26)10-3-4-14-24/h16,18-20,26H,4-9,11-15H2,1-2H3/t16-,18?,19?,20?,21-,22-,23-/m0/s1
    MOLECULAR FORMULA
    C23H33BrO2
    CROSS REFERENCES
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    canSAR833777

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.17
    AlogP 5.12
    HBond donors 1
    HBond acceptors 2
    Atoms 59
    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 canSAR833777.