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canSAR1507727
FEATURES
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NAMES
    SMILES
    C=CCN(CCS(=O)(=O)O)C(=O)C(C)(C)Cc1ccc(C(=O)Oc2ccc(C(=N)N)cc2F)s1
    InChI
    InChI=1S/C22H26FN3O6S2/c1-4-9-26(10-11-34(29,30)31)21(28)22(2,3)13-15-6-8-18(33-15)20(27)32-17-7-5-14(19(24)25)12-16(17)23/h4-8,12H,1,9-11,13H2,2-3H3,(H3,24,25)(H,29,30,31)
    MOLECULAR FORMULA
    C22H26FN3O6S2
    CROSS REFERENCES
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    canSAR1507727

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 511.12
    AlogP 2.86
    HBond donors 4
    HBond acceptors 9
    Atoms 60
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1507727.