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canSAR1859452
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NAMES
    SMILES
    COc1ccc(-n2nnnc2SCC(=O)Nc2cccc(C)n2)cc1OC
    InChI
    InChI=1S/C17H18N6O3S/c1-11-5-4-6-15(18-11)19-16(24)10-27-17-20-21-22-23(17)12-7-8-13(25-2)14(9-12)26-3/h4-9H,10H2,1-3H3,(H,18,19,24)
    MOLECULAR FORMULA
    C17H18N6O3S
    CROSS REFERENCES
    1859452 logo

    canSAR1859452

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.12
    AlogP 2.11
    HBond donors 1
    HBond acceptors 9
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1859452.