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canSAR342735
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NAMES
    SMILES
    CC(C)=CCN1CCC2(C)c3c(ccc(O)c3Br)CC1C2C
    InChI
    InChI=1S/C19H26BrNO/c1-12(2)7-9-21-10-8-19(4)13(3)15(21)11-14-5-6-16(22)18(20)17(14)19/h5-7,13,15,22H,8-11H2,1-4H3
    MOLECULAR FORMULA
    C19H26BrNO
    CROSS REFERENCES
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    canSAR342735

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.12
    AlogP 4.65
    HBond donors 1
    HBond acceptors 2
    Atoms 48
    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 canSAR342735.