canSAR1087578
FEATURES
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NAMES
    SMILES
    COc1cccc(CN(C)Cc2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)c1
    InChI
    InChI=1S/C25H21N3O3/c1-28(13-15-6-5-7-16(12-15)31-2)14-21-26-20-11-10-19-22(23(20)27-21)25(30)18-9-4-3-8-17(18)24(19)29/h3-12H,13-14H2,1-2H3,(H,26,27)
    MOLECULAR FORMULA
    C25H21N3O3
    CROSS REFERENCES
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    canSAR1087578
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight411.16
    AlogP3.98
    HBond donors1
    HBond acceptors6
    Atoms52
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087578.