canSAR2256428
FEATURES
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NAMES
    SMILES
    CCCc1cc2c(-c3ccccc3)cc(=O)oc2cc1OCc1cc(C(=O)O)oc1C
    InChI
    InChI=1S/C25H22O6/c1-3-7-17-10-20-19(16-8-5-4-6-9-16)12-24(26)31-22(20)13-21(17)29-14-18-11-23(25(27)28)30-15(18)2/h4-6,8-13H,3,7,14H2,1-2H3,(H,27,28)
    MOLECULAR FORMULA
    C25H22O6
    CROSS REFERENCES
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    canSAR2256428
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight418.14
    AlogP5.59
    HBond donors1
    HBond acceptors6
    Atoms53
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2256428.