canSAR2080504
FEATURES
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NAMES
    SMILES
    CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(CC2CC2)c2ccccc12
    InChI
    InChI=1S/C23H21N3O/c1-16-21(23(27)26(24-16)19-7-3-2-4-8-19)13-18-15-25(14-17-11-12-17)22-10-6-5-9-20(18)22/h2-10,13,15,17H,11-12,14H2,1H3/b21-13+
    MOLECULAR FORMULA
    C23H21N3O
    CROSS REFERENCES
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    canSAR2080504
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight355.17
    AlogP4.86
    HBond donors0
    HBond acceptors4
    Atoms48
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080504.