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canSAR1098967
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NAMES
    SMILES
    O=S(=O)(Nc1nncs1)c1cc(Cl)c(Oc2cc(OC(F)(F)F)ccc2-c2ccnnc2)cc1F
    InChI
    InChI=1S/C19H10ClF4N5O4S2/c20-13-6-17(35(30,31)29-18-28-27-9-34-18)14(21)7-16(13)32-15-5-11(33-19(22,23)24)1-2-12(15)10-3-4-25-26-8-10/h1-9H,(H,28,29)
    MOLECULAR FORMULA
    C19H10ClF4N5O4S2
    CROSS REFERENCES
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    canSAR1098967

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 546.98
    AlogP 5.28
    HBond donors 1
    HBond acceptors 9
    Atoms 45
    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 canSAR1098967.