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canSAR1015140
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NAMES
    SMILES
    [C-]#[N+][C@@]1(C)CC[C@@H]2[C@@H](C)C[C@@H](C=C(C)C)[C@@H]3C(=C)CC[C@@H]1[C@H]32
    InChI
    InChI=1S/C21H31N/c1-13(2)11-16-12-15(4)17-9-10-21(5,22-6)18-8-7-14(3)19(16)20(17)18/h11,15-20H,3,7-10,12H2,1-2,4-5H3/t15-,16+,17+,18+,19-,20+,21-/m0/s1
    MOLECULAR FORMULA
    C21H31N
    CROSS REFERENCES
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    canSAR1015140

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.25
    AlogP 5.90
    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 canSAR1015140.