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canSAR1971402
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NAMES
    SMILES
    COc1ccc(OC)c(C2C(C(=O)N3CCCCC3)=C(C)Nc3nc4ccccc4n32)c1
    InChI
    InChI=1S/C25H28N4O3/c1-16-22(24(30)28-13-7-4-8-14-28)23(18-15-17(31-2)11-12-21(18)32-3)29-20-10-6-5-9-19(20)27-25(29)26-16/h5-6,9-12,15,23H,4,7-8,13-14H2,1-3H3,(H,26,27)
    MOLECULAR FORMULA
    C25H28N4O3
    CROSS REFERENCES
    1971402 logo

    canSAR1971402

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.22
    AlogP 4.35
    HBond donors 1
    HBond acceptors 7
    Atoms 60
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1971402.