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canSAR928905
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NAMES
    SMILES
    COc1ccc2c(c1)NC(=O)/C2=N\Nc1ccc(C(C)C)cc1
    InChI
    InChI=1S/C18H19N3O2/c1-11(2)12-4-6-13(7-5-12)20-21-17-15-9-8-14(23-3)10-16(15)19-18(17)22/h4-11,20H,1-3H3,(H,19,21,22)
    MOLECULAR FORMULA
    C18H19N3O2
    CROSS REFERENCES
    928905 logo

    canSAR928905

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 309.15
    AlogP 3.59
    HBond donors 2
    HBond acceptors 5
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR928905.