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canSAR1064493
FEATURES
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NAMES
    SMILES
    O=C1NC(=S)NC(=O)C1=Cc1ccc(OCc2ccc(Br)cc2)cc1
    InChI
    InChI=1S/C18H13BrN2O3S/c19-13-5-1-12(2-6-13)10-24-14-7-3-11(4-8-14)9-15-16(22)20-18(25)21-17(15)23/h1-9H,10H2,(H2,20,21,22,23,25)
    MOLECULAR FORMULA
    C18H13BrN2O3S
    CROSS REFERENCES
    1064493 logo

    canSAR1064493

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.98
    AlogP 2.94
    HBond donors 2
    HBond acceptors 5
    Atoms 38
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1064493.