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canSAR1149914
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NAMES
    SMILES
    CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccccc1/C=C/C(=O)N(C)C(C)(C)C
    InChI
    InChI=1S/C27H36N2O5/c1-9-33-25(31)22-17(3)28-18(4)23(26(32)34-10-2)24(22)20-14-12-11-13-19(20)15-16-21(30)29(8)27(5,6)7/h11-16,24,28H,9-10H2,1-8H3/b16-15+
    MOLECULAR FORMULA
    C27H36N2O5
    CROSS REFERENCES
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    canSAR1149914

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.26
    AlogP 4.32
    HBond donors 1
    HBond acceptors 7
    Atoms 70
    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 canSAR1149914.