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canSAR2016768
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NAMES
    SMILES
    CC(C)c1cnc2c(c1SCC(=O)O)c(=O)n(C)c(=O)n2C
    InChI
    InChI=1S/C14H17N3O4S/c1-7(2)8-5-15-12-10(11(8)22-6-9(18)19)13(20)17(4)14(21)16(12)3/h5,7H,6H2,1-4H3,(H,18,19)
    MOLECULAR FORMULA
    C14H17N3O4S
    CROSS REFERENCES
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    canSAR2016768

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 323.09
    AlogP 0.93
    HBond donors 1
    HBond acceptors 7
    Atoms 39
    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 canSAR2016768.