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canSAR2019164
FEATURES
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NAMES
    SMILES
    Br.O=C(Cn1c(NCCO)nc2ccccc21)c1ccc([N+](=O)[O-])cc1
    InChI
    InChI=1S/C17H16N4O4.BrH/c22-10-9-18-17-19-14-3-1-2-4-15(14)20(17)11-16(23)12-5-7-13(8-6-12)21(24)25;/h1-8,22H,9-11H2,(H,18,19);1H
    MOLECULAR FORMULA
    C17H17BrN4O4
    CROSS REFERENCES
    2019164 logo

    canSAR2019164

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.04
    AlogP 2.81
    HBond donors 2
    HBond acceptors 8
    Atoms 43
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2019164.