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canSAR778683
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NAMES
    SMILES
    [C-]#[N+][C@@]1(C)CC[C@@H]2[C@@H](C)C[C@H]3C=C(C)[C@@H](C)[C@H]4CC[C@H]1[C@@H]2[C@@H]43
    InChI
    InChI=1S/C21H31N/c1-12-10-15-11-13(2)16-8-9-21(4,22-5)18-7-6-17(14(12)3)19(15)20(16)18/h10,13-20H,6-9,11H2,1-4H3/t13-,14+,15+,16+,17+,18-,19+,20+,21-/m0/s1
    MOLECULAR FORMULA
    C21H31N
    CROSS REFERENCES
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    canSAR778683

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.25
    AlogP 5.58
    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 canSAR778683.