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canSAR113030
FEATURES
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NAMES
    SMILES
    COCCc1c(C(=O)OC)[n+]([O-])c2cc(Cl)c(Cl)cc2[n+]1[O-]
    InChI
    InChI=1S/C13H12Cl2N2O5/c1-21-4-3-9-12(13(18)22-2)17(20)11-6-8(15)7(14)5-10(11)16(9)19/h5-6H,3-4H2,1-2H3
    MOLECULAR FORMULA
    C13H12Cl2N2O5
    CROSS REFERENCES
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    canSAR113030

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 346.01
    AlogP 1.39
    HBond donors 0
    HBond acceptors 7
    Atoms 34
    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 canSAR113030.