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canSAR778106
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NAMES
    SMILES
    CC(C)Cc1ccc(-c2cc(Cl)c(O)c(C(=O)O)c2)cc1
    InChI
    InChI=1S/C17H17ClO3/c1-10(2)7-11-3-5-12(6-4-11)13-8-14(17(20)21)16(19)15(18)9-13/h3-6,8-10,19H,7H2,1-2H3,(H,20,21)
    MOLECULAR FORMULA
    C17H17ClO3
    CROSS REFERENCES
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    canSAR778106

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 304.09
    AlogP 4.61
    HBond donors 2
    HBond acceptors 3
    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 canSAR778106.