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canSAR354029
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NAMES
    SMILES
    O=C(NO)C1(S(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)CCNCC1
    InChI
    InChI=1S/C18H19ClN2O5S/c19-13-1-3-14(4-2-13)26-15-5-7-16(8-6-15)27(24,25)18(17(22)21-23)9-11-20-12-10-18/h1-8,20,23H,9-12H2,(H,21,22)
    MOLECULAR FORMULA
    C18H19ClN2O5S
    CROSS REFERENCES
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    canSAR354029

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.07
    AlogP 2.53
    HBond donors 3
    HBond acceptors 7
    Atoms 46
    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 canSAR354029.