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canSAR1979449
FEATURES
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NAMES
    SMILES
    CCC(=O)Nc1cccc(NC(=O)CSc2nnc(-c3ccc(NS(C)(=O)=O)cc3)n2CC)c1
    InChI
    InChI=1S/C22H26N6O4S2/c1-4-19(29)23-17-7-6-8-18(13-17)24-20(30)14-33-22-26-25-21(28(22)5-2)15-9-11-16(12-10-15)27-34(3,31)32/h6-13,27H,4-5,14H2,1-3H3,(H,23,29)(H,24,30)
    MOLECULAR FORMULA
    C22H26N6O4S2
    CROSS REFERENCES
    1979449 logo

    canSAR1979449

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.15
    AlogP 3.42
    HBond donors 3
    HBond acceptors 10
    Atoms 60
    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 canSAR1979449.