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canSAR1208144
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NAMES
    SMILES
    CC(=O)[C@@]1(OC(=O)Nc2ccccc2)CC[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
    InChI
    InChI=1S/C28H33NO4/c1-18(30)28(33-25(32)29-20-7-5-4-6-8-20)16-13-24-22-10-9-19-17-21(31)11-14-26(19,2)23(22)12-15-27(24,28)3/h4-10,17,22-24H,11-16H2,1-3H3,(H,29,32)/t22-,23+,24+,26+,27+,28+/m1/s1
    MOLECULAR FORMULA
    C28H33NO4
    CROSS REFERENCES
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    canSAR1208144

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 447.24
    AlogP 5.87
    HBond donors 1
    HBond acceptors 5
    Atoms 66
    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 canSAR1208144.