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canSAR1529064
FEATURES
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NAMES
    SMILES
    O=C(c1ccc(COc2ccccc2[N+](=O)[O-])o1)N1CCCCC1
    InChI
    InChI=1S/C17H18N2O5/c20-17(18-10-4-1-5-11-18)16-9-8-13(24-16)12-23-15-7-3-2-6-14(15)19(21)22/h2-3,6-9H,1,4-5,10-12H2
    MOLECULAR FORMULA
    C17H18N2O5
    CROSS REFERENCES
    1529064 logo

    canSAR1529064

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 330.12
    AlogP 3.39
    HBond donors 0
    HBond acceptors 7
    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 canSAR1529064.