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canSAR1616046
FEATURES
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NAMES
    SMILES
    COc1ccccc1NC(=O)Cc1noc(CSc2nnc(C(F)(F)F)n2C)n1
    InChI
    InChI=1S/C16H15F3N6O3S/c1-25-14(16(17,18)19)22-23-15(25)29-8-13-21-11(24-28-13)7-12(26)20-9-5-3-4-6-10(9)27-2/h3-6H,7-8H2,1-2H3,(H,20,26)
    MOLECULAR FORMULA
    C16H15F3N6O3S
    CROSS REFERENCES
    1616046 logo

    canSAR1616046

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.09
    AlogP 2.70
    HBond donors 1
    HBond acceptors 9
    Atoms 44
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1616046.