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canSAR114412
FEATURES
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NAMES
    SMILES
    CONC1=NC(=O)/C(=C/c2ccc3ncccc3c2)S1
    InChI
    InChI=1S/C14H11N3O2S/c1-19-17-14-16-13(18)12(20-14)8-9-4-5-11-10(7-9)3-2-6-15-11/h2-8H,1H3,(H,16,17,18)/b12-8-
    MOLECULAR FORMULA
    C14H11N3O2S
    CROSS REFERENCES
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    canSAR114412

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 285.06
    AlogP 2.36
    HBond donors 1
    HBond acceptors 5
    Atoms 31
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR114412.