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canSAR466819
FEATURES
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NAMES
    SMILES
    COc1c(OC)c(OC(C)=O)c2c(Sc3ccccc3)cccc2c1OC(C)=O
    InChI
    InChI=1S/C22H20O6S/c1-13(23)27-19-16-11-8-12-17(29-15-9-6-5-7-10-15)18(16)20(28-14(2)24)22(26-4)21(19)25-3/h5-12H,1-4H3
    MOLECULAR FORMULA
    C22H20O6S
    CROSS REFERENCES
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    canSAR466819

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.10
    AlogP 4.86
    HBond donors 0
    HBond acceptors 6
    Atoms 49
    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 canSAR466819.