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canSAR782134
FEATURES
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NAMES
    SMILES
    Cc1ccc(C(=O)/C=C/C2=C/C(=C/NC(C)(C)C)C(=O)c3ccc4c(C)cc(=O)oc4c32)cc1
    InChI
    InChI=1S/C29H27NO4/c1-17-6-8-19(9-7-17)24(31)13-10-20-15-21(16-30-29(3,4)5)27(33)23-12-11-22-18(2)14-25(32)34-28(22)26(20)23/h6-16,30H,1-5H3/b13-10+,21-16-
    MOLECULAR FORMULA
    C29H27NO4
    CROSS REFERENCES
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    canSAR782134

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 453.19
    AlogP 5.70
    HBond donors 1
    HBond acceptors 5
    Atoms 61
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR782134.