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canSAR1201030
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NAMES
    SMILES
    C#CCc1c(Cl)cc(N/C=N/OC/C=C/Cl)cc1Cl
    InChI
    InChI=1S/C13H11Cl3N2O/c1-2-4-11-12(15)7-10(8-13(11)16)17-9-18-19-6-3-5-14/h1,3,5,7-9H,4,6H2,(H,17,18)/b5-3+
    MOLECULAR FORMULA
    C13H11Cl3N2O
    CROSS REFERENCES
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    canSAR1201030

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 315.99
    AlogP 4.29
    HBond donors 1
    HBond acceptors 3
    Atoms 30
    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 canSAR1201030.