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canSAR1949891
FEATURES
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NAMES
    SMILES
    Cc1ccc(NC2=NC(=O)C(=Cc3cn(C)c4ccccc34)S2)cc1C
    InChI
    InChI=1S/C21H19N3OS/c1-13-8-9-16(10-14(13)2)22-21-23-20(25)19(26-21)11-15-12-24(3)18-7-5-4-6-17(15)18/h4-12H,1-3H3,(H,22,23,25)
    MOLECULAR FORMULA
    C21H19N3OS
    CROSS REFERENCES
    1949891 logo

    canSAR1949891

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.12
    AlogP 4.88
    HBond donors 1
    HBond acceptors 4
    Atoms 45
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1949891.