canSAR138714
FEATURES
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NAMES
    SMILES
    COc1ccc2cc(C(C)c3nnc4sc(-c5ccccc5N)nn34)ccc2c1
    InChI
    InChI=1S/C22H19N5OS/c1-13(14-7-8-16-12-17(28-2)10-9-15(16)11-14)20-24-25-22-27(20)26-21(29-22)18-5-3-4-6-19(18)23/h3-13H,23H2,1-2H3
    MOLECULAR FORMULA
    C22H19N5OS
    CROSS REFERENCES
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    canSAR138714
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight401.13
    AlogP4.75
    HBond donors2
    HBond acceptors6
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR138714.