canSAR2080412
FEATURES
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NAMES
    SMILES
    CCOC(C)Oc1cc2ncnc(Nc3ccc(OC)c([N+](=O)[O-])c3)c2c2c1OCCO2
    InChI
    InChI=1S/C21H22N4O7/c1-4-29-12(2)32-17-10-14-18(20-19(17)30-7-8-31-20)21(23-11-22-14)24-13-5-6-16(28-3)15(9-13)25(26)27/h5-6,9-12H,4,7-8H2,1-3H3,(H,22,23,24)
    MOLECULAR FORMULA
    C21H22N4O7
    CROSS REFERENCES
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    canSAR2080412
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight442.15
    AlogP3.82
    HBond donors1
    HBond acceptors11
    Atoms54
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080412.