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canSAR1154293
FEATURES
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NAMES
    SMILES
    COc1cccc2c1C(=O)C1=C(C[C@H](Cn3nnc4ccccc43)O[C@@H]1C)C2=O
    InChI
    InChI=1S/C22H19N3O4/c1-12-19-15(21(26)14-6-5-9-18(28-2)20(14)22(19)27)10-13(29-12)11-25-17-8-4-3-7-16(17)23-24-25/h3-9,12-13H,10-11H2,1-2H3/t12-,13-/m1/s1
    MOLECULAR FORMULA
    C22H19N3O4
    CROSS REFERENCES
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    canSAR1154293

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 389.14
    AlogP 2.99
    HBond donors 0
    HBond acceptors 7
    Atoms 48
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1154293.