canSAR635441
FEATURES
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NAMES
    SMILES
    CC(=O)OCC1OC(n2c3c(c(-c4ccco4)c(C#N)c2=S)CCCC3)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O
    InChI
    InChI=1S/C28H30N2O10S/c1-14(31)36-13-22-24(37-15(2)32)25(38-16(3)33)26(39-17(4)34)27(40-22)30-20-9-6-5-8-18(20)23(19(12-29)28(30)41)21-10-7-11-35-21/h7,10-11,22,24-27H,5-6,8-9,13H2,1-4H3
    MOLECULAR FORMULA
    C28H30N2O10S
    CROSS REFERENCES
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    canSAR635441
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight586.16
    AlogP3.48
    HBond donors0
    HBond acceptors12
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR635441.