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canSAR1061268
FEATURES
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NAMES
    SMILES
    CCSC(=O)N1CCC(Oc2ncnc3c2CCN3c2ccc(S(C)(=O)=O)cc2F)CC1
    InChI
    InChI=1S/C21H25FN4O4S2/c1-3-31-21(27)25-9-6-14(7-10-25)30-20-16-8-11-26(19(16)23-13-24-20)18-5-4-15(12-17(18)22)32(2,28)29/h4-5,12-14H,3,6-11H2,1-2H3
    MOLECULAR FORMULA
    C21H25FN4O4S2
    CROSS REFERENCES
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    canSAR1061268

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.13
    AlogP 3.43
    HBond donors 0
    HBond acceptors 8
    Atoms 57
    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 canSAR1061268.