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canSAR933794
FEATURES
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NAMES
    SMILES
    C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC(C#N)C2=O
    InChI
    InChI=1S/C19H21NO2/c1-19-7-6-15-14-5-3-13(21)8-11(14)2-4-16(15)17(19)9-12(10-20)18(19)22/h3,5,8,12,15-17,21H,2,4,6-7,9H2,1H3/t12?,15-,16-,17+,19+/m1/s1
    MOLECULAR FORMULA
    C19H21NO2
    CROSS REFERENCES
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    canSAR933794

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 295.16
    AlogP 3.57
    HBond donors 1
    HBond acceptors 3
    Atoms 43
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR933794.