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canSAR1444058
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NAMES
    SMILES
    Cc1ccccc1-n1ccnc1SCC(=O)Nc1cccc(S(=O)(=O)NC2=NCCC2)c1
    InChI
    InChI=1S/C22H23N5O3S2/c1-16-6-2-3-9-19(16)27-13-12-24-22(27)31-15-21(28)25-17-7-4-8-18(14-17)32(29,30)26-20-10-5-11-23-20/h2-4,6-9,12-14H,5,10-11,15H2,1H3,(H,23,26)(H,25,28)
    MOLECULAR FORMULA
    C22H23N5O3S2
    CROSS REFERENCES
    1444058 logo

    canSAR1444058

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 469.12
    AlogP 3.38
    HBond donors 2
    HBond acceptors 8
    Atoms 55
    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 canSAR1444058.