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canSAR836868
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NAMES
    SMILES
    CCCc1cc(O)c(Oc2ccc(C#N)cc2Cl)c(OC)c1
    InChI
    InChI=1S/C17H16ClNO3/c1-3-4-11-8-14(20)17(16(9-11)21-2)22-15-6-5-12(10-19)7-13(15)18/h5-9,20H,3-4H2,1-2H3
    MOLECULAR FORMULA
    C17H16ClNO3
    CROSS REFERENCES
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    canSAR836868

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 317.08
    AlogP 4.67
    HBond donors 1
    HBond acceptors 4
    Atoms 38
    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 canSAR836868.