canSAR2061869
FEATURES
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NAMES
    SMILES
    COC(=O)[C@@H](CCSC)NC(=O)[C@]1(C)CCC[C@]2(C)c3ccc(C(C)C)cc3CC[C@H]21
    InChI
    InChI=1S/C26H39NO3S/c1-17(2)18-8-10-20-19(16-18)9-11-22-25(20,3)13-7-14-26(22,4)24(29)27-21(12-15-31-6)23(28)30-5/h8,10,16-17,21-22H,7,9,11-15H2,1-6H3,(H,27,29)/t21-,22-,25-,26-/m1/s1
    MOLECULAR FORMULA
    C26H39NO3S
    CROSS REFERENCES
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    canSAR2061869
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight445.27
    AlogP5.23
    HBond donors1
    HBond acceptors4
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2061869.