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canSAR2017102
FEATURES
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NAMES
    SMILES
    Cc1cc(NC(=O)COC(=O)c2ccc(NS(=O)(=O)c3ccc(C)c(C)c3)cc2)no1
    InChI
    InChI=1S/C21H21N3O6S/c1-13-4-9-18(10-14(13)2)31(27,28)24-17-7-5-16(6-8-17)21(26)29-12-20(25)22-19-11-15(3)30-23-19/h4-11,24H,12H2,1-3H3,(H,22,23,25)
    MOLECULAR FORMULA
    C21H21N3O6S
    CROSS REFERENCES
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    canSAR2017102

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.12
    AlogP 3.20
    HBond donors 2
    HBond acceptors 9
    Atoms 52
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2017102.