canSAR1089018
FEATURES
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NAMES
    SMILES
    C=CCN(CC=C)C(=O)/C=C/c1c(/C=C/c2ccc(OC)cc2)cc(OC)cc1OC
    InChI
    InChI=1S/C26H29NO4/c1-6-16-27(17-7-2)26(28)15-14-24-21(18-23(30-4)19-25(24)31-5)11-8-20-9-12-22(29-3)13-10-20/h6-15,18-19H,1-2,16-17H2,3-5H3/b11-8+,15-14+
    MOLECULAR FORMULA
    C26H29NO4
    CROSS REFERENCES
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    canSAR1089018
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight419.21
    AlogP5.10
    HBond donors0
    HBond acceptors5
    Atoms60
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1089018.