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canSAR344262
FEATURES
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NAMES
    SMILES
    CC(=O)O/N=C1/C(c2c(O)[nH]c3cc(Br)ccc23)=Nc2ccccc21
    InChI
    InChI=1S/C18H12BrN3O3/c1-9(23)25-22-16-12-4-2-3-5-13(12)20-17(16)15-11-7-6-10(19)8-14(11)21-18(15)24/h2-8,21,24H,1H3/b22-16+
    MOLECULAR FORMULA
    C18H12BrN3O3
    CROSS REFERENCES
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    canSAR344262

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.01
    AlogP 4.04
    HBond donors 2
    HBond acceptors 6
    Atoms 37
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR344262.