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canSAR2000002
FEATURES
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NAMES
    SMILES
    COc1ccc(CC(=O)NN=C(C)c2ccc(Br)s2)cc1
    InChI
    InChI=1S/C15H15BrN2O2S/c1-10(13-7-8-14(16)21-13)17-18-15(19)9-11-3-5-12(20-2)6-4-11/h3-8H,9H2,1-2H3,(H,18,19)
    MOLECULAR FORMULA
    C15H15BrN2O2S
    CROSS REFERENCES
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    canSAR2000002

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 366.00
    AlogP 3.60
    HBond donors 1
    HBond acceptors 4
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2000002.