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canSAR782426
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NAMES
    SMILES
    C[C@H]1C[C@H]2C[C@@H](C)[C@@](C)(C#N)[C@H]3CC[C@H]4[C@H]([C@H]23)[C@@H]1CC[C@]4(C)NC=O
    InChI
    InChI=1S/C22H34N2O/c1-13-9-15-10-14(2)21(3,11-23)17-5-6-18-20(19(15)17)16(13)7-8-22(18,4)24-12-25/h12-20H,5-10H2,1-4H3,(H,24,25)/t13-,14+,15-,16+,17-,18-,19+,20+,21+,22-/m0/s1
    MOLECULAR FORMULA
    C22H34N2O
    CROSS REFERENCES
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    canSAR782426

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.27
    AlogP 4.39
    HBond donors 1
    HBond acceptors 3
    Atoms 59
    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 canSAR782426.