canSAR1773540
FEATURES
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NAMES
    SMILES
    CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@]21C(=O)N(CC(N)=O)c2ccccc21
    InChI
    InChI=1S/C21H20N4O4/c1-20(2)7-14(26)17-15(8-20)29-18(24)12(9-22)21(17)11-5-3-4-6-13(11)25(19(21)28)10-16(23)27/h3-6H,7-8,10,24H2,1-2H3,(H2,23,27)/t21-/m1/s1
    MOLECULAR FORMULA
    C21H20N4O4
    CROSS REFERENCES
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    canSAR1773540
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight392.15
    AlogP1.12
    HBond donors4
    HBond acceptors8
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1773540.