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canSAR1093286
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NAMES
    SMILES
    C=C(C)[C@@H]1CC[C@]2([C@H](O)C#CCN(C(C)C)C(C)C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
    InChI
    InChI=1S/C39H65NO2/c1-25(2)28-16-21-39(33(42)13-12-24-40(26(3)4)27(5)6)23-22-37(10)29(34(28)39)14-15-31-36(9)19-18-32(41)35(7,8)30(36)17-20-38(31,37)11/h26-34,41-42H,1,14-24H2,2-11H3/t28-,29+,30-,31+,32-,33+,34+,36-,37+,38+,39+/m0/s1
    MOLECULAR FORMULA
    C39H65NO2
    CROSS REFERENCES
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    canSAR1093286

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 579.50
    AlogP 8.49
    HBond donors 2
    HBond acceptors 3
    Atoms 107
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1093286.