canSAR1709712
FEATURES
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NAMES
    SMILES
    C=Cn1cc[n+](CC(=O)c2ccc(OC)cc2)c1
    InChI
    InChI=1S/C14H15N2O2/c1-3-15-8-9-16(11-15)10-14(17)12-4-6-13(18-2)7-5-12/h3-9,11H,1,10H2,2H3/q+1
    MOLECULAR FORMULA
    C14H15N2O2+
    CROSS REFERENCES
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    canSAR1709712
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight243.11
    AlogP1.77
    HBond donors0
    HBond acceptors4
    Atoms33
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1709712.