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canSAR1024537
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NAMES
    SMILES
    CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]
    InChI
    InChI=1S/C18H24N4O4S2/c1-21(2)11-10-14(13-27-15-6-4-3-5-7-15)20-17-9-8-16(28(19,25)26)12-18(17)22(23)24/h3-9,12,14,20H,10-11,13H2,1-2H3,(H2,19,25,26)/t14-/m1/s1
    MOLECULAR FORMULA
    C18H24N4O4S2
    CROSS REFERENCES
    1024537 logo

    canSAR1024537

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 424.12
    AlogP 2.77
    HBond donors 3
    HBond acceptors 8
    Atoms 52
    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 canSAR1024537.