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canSAR466796
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NAMES
    SMILES
    CNc1nccc(-c2ccc(C(=O)NCCc3ccc(S(N)(=O)=O)cc3)s2)n1
    InChI
    InChI=1S/C18H19N5O3S2/c1-20-18-22-11-9-14(23-18)15-6-7-16(27-15)17(24)21-10-8-12-2-4-13(5-3-12)28(19,25)26/h2-7,9,11H,8,10H2,1H3,(H,21,24)(H2,19,25,26)(H,20,22,23)
    MOLECULAR FORMULA
    C18H19N5O3S2
    CROSS REFERENCES
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    canSAR466796

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 417.09
    AlogP 1.87
    HBond donors 4
    HBond acceptors 8
    Atoms 47
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR466796.