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canSAR546962
FEATURES
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NAMES
    SMILES
    CC[N+](CC)(CC)Cc1c(C)oc2c(C)c3oc(=O)cc(C)c3cc12
    InChI
    InChI=1S/C21H28NO3/c1-7-22(8-2,9-3)12-18-15(6)24-21-14(5)20-16(11-17(18)21)13(4)10-19(23)25-20/h10-11H,7-9,12H2,1-6H3/q+1
    MOLECULAR FORMULA
    C21H28NO3+
    CROSS REFERENCES
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    canSAR546962

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.21
    AlogP 4.84
    HBond donors 0
    HBond acceptors 4
    Atoms 53
    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 canSAR546962.