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canSAR1100191
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NAMES
    SMILES
    Nc1cc(-c2cc(OC(F)(F)F)ccc2Oc2cc(F)c(S(=O)(=O)Nc3ncns3)cc2Cl)ccn1
    InChI
    InChI=1S/C20H12ClF4N5O4S2/c21-13-7-17(36(31,32)30-19-28-9-29-35-19)14(22)8-16(13)33-15-2-1-11(34-20(23,24)25)6-12(15)10-3-4-27-18(26)5-10/h1-9H,(H2,26,27)(H,28,29,30)
    MOLECULAR FORMULA
    C20H12ClF4N5O4S2
    CROSS REFERENCES
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    canSAR1100191

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 561.00
    AlogP 5.47
    HBond donors 3
    HBond acceptors 9
    Atoms 48
    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 canSAR1100191.