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canSAR1404758
FEATURES
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NAMES
    SMILES
    COc1ccc(/C=C/C(=O)NC(Cc2ccccc2)C(=O)N2CCC[C@H]2C#N)cc1
    InChI
    InChI=1S/C24H25N3O3/c1-30-21-12-9-18(10-13-21)11-14-23(28)26-22(16-19-6-3-2-4-7-19)24(29)27-15-5-8-20(27)17-25/h2-4,6-7,9-14,20,22H,5,8,15-16H2,1H3,(H,26,28)/b14-11+/t20-,22?/m0/s1
    MOLECULAR FORMULA
    C24H25N3O3
    CROSS REFERENCES
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    canSAR1404758

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.19
    AlogP 2.95
    HBond donors 1
    HBond acceptors 6
    Atoms 55
    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 canSAR1404758.