canSAR2080406
FEATURES
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NAMES
    SMILES
    C#Cc1cccc(Nc2ncnc3cc(OCCO)c(OCCOC)cc23)c1
    InChI
    InChI=1S/C21H21N3O4/c1-3-15-5-4-6-16(11-15)24-21-17-12-19(28-10-9-26-2)20(27-8-7-25)13-18(17)22-14-23-21/h1,4-6,11-14,25H,7-10H2,2H3,(H,22,23,24)
    MOLECULAR FORMULA
    C21H21N3O4
    CROSS REFERENCES
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    canSAR2080406
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight379.15
    AlogP2.75
    HBond donors2
    HBond acceptors7
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080406.