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canSAR50314
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NAMES
    SMILES
    CSc1ccccc1-c1nc(C)c(-c2cccnc2)[nH]1
    InChI
    InChI=1S/C16H15N3S/c1-11-15(12-6-5-9-17-10-12)19-16(18-11)13-7-3-4-8-14(13)20-2/h3-10H,1-2H3,(H,18,19)
    MOLECULAR FORMULA
    C16H15N3S
    CROSS REFERENCES
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    canSAR50314

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 281.10
    AlogP 4.17
    HBond donors 1
    HBond acceptors 3
    Atoms 35
    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 canSAR50314.