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canSAR836477
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NAMES
    SMILES
    [C-]#[N+][C@@]1(C)CC[C@@H]2[C@@H](C)C[C@H]3CC(C)(C)CC4=CC[C@H]1[C@@H]2[C@@H]43
    InChI
    InChI=1S/C21H31N/c1-13-10-15-12-20(2,3)11-14-6-7-17-19(18(14)15)16(13)8-9-21(17,4)22-5/h6,13,15-19H,7-12H2,1-4H3/t13-,15-,16+,17-,18-,19+,21-/m0/s1
    MOLECULAR FORMULA
    C21H31N
    CROSS REFERENCES
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    canSAR836477

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.25
    AlogP 5.73
    HBond donors 0
    HBond acceptors 1
    Atoms 53
    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 canSAR836477.