canSAR637443
FEATURES
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NAMES
    SMILES
    COc1ccc(-c2cc(-c3ccccc3)n(C3OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)c(=S)c2C#N)cc1
    InChI
    InChI=1S/C33H32N2O10S/c1-18(36)41-17-28-29(42-19(2)37)30(43-20(3)38)31(44-21(4)39)32(45-28)35-27(23-9-7-6-8-10-23)15-25(26(16-34)33(35)46)22-11-13-24(40-5)14-12-22/h6-15,28-32H,17H2,1-5H3
    MOLECULAR FORMULA
    C33H32N2O10S
    CROSS REFERENCES
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    canSAR637443
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight648.18
    AlogP4.69
    HBond donors0
    HBond acceptors12
    Atoms78
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR637443.