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canSAR1144670
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NAMES
    SMILES
    COc1ccccc1-n1c(S)nnc1-c1csc(NC(=S)Nc2ccccc2)n1
    InChI
    InChI=1S/C19H16N6OS3/c1-26-15-10-6-5-9-14(15)25-16(23-24-19(25)28)13-11-29-18(21-13)22-17(27)20-12-7-3-2-4-8-12/h2-11H,1H3,(H,24,28)(H2,20,21,22,27)
    MOLECULAR FORMULA
    C19H16N6OS3
    CROSS REFERENCES
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    canSAR1144670

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.05
    AlogP 4.50
    HBond donors 2
    HBond acceptors 7
    Atoms 45
    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 canSAR1144670.