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canSAR1971910
FEATURES
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NAMES
    SMILES
    COc1ccc(/C=N/NC2=NC(=O)C(c3ccccc3)S2)c(OC)c1
    InChI
    InChI=1S/C18H17N3O3S/c1-23-14-9-8-13(15(10-14)24-2)11-19-21-18-20-17(22)16(25-18)12-6-4-3-5-7-12/h3-11,16H,1-2H3,(H,20,21,22)/b19-11+
    MOLECULAR FORMULA
    C18H17N3O3S
    CROSS REFERENCES
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    canSAR1971910

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.10
    AlogP 3.00
    HBond donors 1
    HBond acceptors 6
    Atoms 42
    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 canSAR1971910.