canSAR108508
FEATURES
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NAMES
    SMILES
    CC(=O)Oc1cc(C(=O)Cc2ccc([N+](=O)[O-])cc2)cc([N+](=O)[O-])c1OC(C)=O
    InChI
    InChI=1S/C18H14N2O9/c1-10(21)28-17-9-13(8-15(20(26)27)18(17)29-11(2)22)16(23)7-12-3-5-14(6-4-12)19(24)25/h3-6,8-9H,7H2,1-2H3
    MOLECULAR FORMULA
    C18H14N2O9
    CROSS REFERENCES
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    canSAR108508
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight402.07
    AlogP2.78
    HBond donors0
    HBond acceptors11
    Atoms43
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR108508.