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canSAR787045
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NAMES
    SMILES
    CCN1CCC(n2cc(S(=O)(=O)c3c(Cl)nc4sccn34)c3cccnc32)C1
    InChI
    InChI=1S/C18H18ClN5O2S2/c1-2-22-7-5-12(10-22)24-11-14(13-4-3-6-20-16(13)24)28(25,26)17-15(19)21-18-23(17)8-9-27-18/h3-4,6,8-9,11-12H,2,5,7,10H2,1H3
    MOLECULAR FORMULA
    C18H18ClN5O2S2
    CROSS REFERENCES
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    canSAR787045

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.06
    AlogP 3.50
    HBond donors 0
    HBond acceptors 7
    Atoms 46
    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 canSAR787045.