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canSAR35336
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NAMES
    SMILES
    Cc1cccc(NC(=S)N2CCC(c3cccc(Br)c3)=N2)c1
    InChI
    InChI=1S/C17H16BrN3S/c1-12-4-2-7-15(10-12)19-17(22)21-9-8-16(20-21)13-5-3-6-14(18)11-13/h2-7,10-11H,8-9H2,1H3,(H,19,22)
    MOLECULAR FORMULA
    C17H16BrN3S
    CROSS REFERENCES
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    canSAR35336

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 373.02
    AlogP 4.56
    HBond donors 1
    HBond acceptors 3
    Atoms 38
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR35336.