canSAR1773822
FEATURES
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NAMES
    SMILES
    C=CCNC(=O)/C(C#N)=C/c1c(N2CC(C)OC(C)C2)nc2ccccn2c1=O
    InChI
    InChI=1S/C21H23N5O3/c1-4-8-23-20(27)16(11-22)10-17-19(25-12-14(2)29-15(3)13-25)24-18-7-5-6-9-26(18)21(17)28/h4-7,9-10,14-15H,1,8,12-13H2,2-3H3,(H,23,27)/b16-10+
    MOLECULAR FORMULA
    C21H23N5O3
    CROSS REFERENCES
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    canSAR1773822
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight393.18
    AlogP1.52
    HBond donors1
    HBond acceptors8
    Atoms52
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1773822.