canSAR1650467
FEATURES
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NAMES
    SMILES
    COc1cc(OC)cc(C(=O)NC(C)CNc2ccc(Cl)cc2[N+](=O)[O-])c1
    InChI
    InChI=1S/C18H20ClN3O5/c1-11(10-20-16-5-4-13(19)8-17(16)22(24)25)21-18(23)12-6-14(26-2)9-15(7-12)27-3/h4-9,11,20H,10H2,1-3H3,(H,21,23)
    MOLECULAR FORMULA
    C18H20ClN3O5
    CROSS REFERENCES
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    canSAR1650467
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight393.11
    AlogP3.50
    HBond donors2
    HBond acceptors8
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1650467.