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canSAR5632
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NAMES
    SMILES
    O=C(NO)c1c(Cl)cccc1S(=O)(=O)N1CCC(Oc2ccc(C(F)(F)F)cc2)CC1
    InChI
    InChI=1S/C19H18ClF3N2O5S/c20-15-2-1-3-16(17(15)18(26)24-27)31(28,29)25-10-8-14(9-11-25)30-13-6-4-12(5-7-13)19(21,22)23/h1-7,14,27H,8-11H2,(H,24,26)
    MOLECULAR FORMULA
    C19H18ClF3N2O5S
    CROSS REFERENCES
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    canSAR5632

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 478.06
    AlogP 3.71
    HBond donors 2
    HBond acceptors 7
    Atoms 49
    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 canSAR5632.