canSAR382718
FEATURES
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NAMES
    SMILES
    CCCNCC(O)COc1ccc2c(=O)c(-c3ccccc3)c(-c3ccccc3)oc2c1
    InChI
    InChI=1S/C27H27NO4/c1-2-15-28-17-21(29)18-31-22-13-14-23-24(16-22)32-27(20-11-7-4-8-12-20)25(26(23)30)19-9-5-3-6-10-19/h3-14,16,21,28-29H,2,15,17-18H2,1H3
    MOLECULAR FORMULA
    C27H27NO4
    CROSS REFERENCES
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    canSAR382718
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight429.19
    AlogP4.87
    HBond donors2
    HBond acceptors5
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR382718.