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canSAR1151084
FEATURES
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NAMES
    SMILES
    COc1ccc2c3c1O[C@@H]1C[C@H](O)C=C[C@]31CCN([11CH3])C2
    InChI
    InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m1/s1/i1-1
    MOLECULAR FORMULA
    C17H21NO3
    CROSS REFERENCES
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    canSAR1151084

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 286.16
    AlogP 1.85
    HBond donors 1
    HBond acceptors 4
    Atoms 42
    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 canSAR1151084.