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canSAR1727196
FEATURES
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NAMES
    SMILES
    CC(C)=CCOc1ccc(C2=C(CC(C)C)C(=O)N(C(C(=O)O)C(C)O)C2=O)cc1
    InChI
    InChI=1S/C23H29NO6/c1-13(2)10-11-30-17-8-6-16(7-9-17)19-18(12-14(3)4)21(26)24(22(19)27)20(15(5)25)23(28)29/h6-10,14-15,20,25H,11-12H2,1-5H3,(H,28,29)
    MOLECULAR FORMULA
    C23H29NO6
    CROSS REFERENCES
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    canSAR1727196

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.20
    AlogP 3.03
    HBond donors 2
    HBond acceptors 7
    Atoms 59
    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 canSAR1727196.