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canSAR66022
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NAMES
    SMILES
    CCOC(=O)c1nc2c(O)nc3cc([N+](=O)[O-])c(-n4ccc(C(=O)O)c4)cc3n2n1
    InChI
    InChI=1S/C17H12N6O7/c1-2-30-17(27)13-19-14-15(24)18-9-5-12(23(28)29)11(6-10(9)22(14)20-13)21-4-3-8(7-21)16(25)26/h3-7H,2H2,1H3,(H,18,24)(H,25,26)
    MOLECULAR FORMULA
    C17H12N6O7
    CROSS REFERENCES
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    canSAR66022

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.08
    AlogP 1.56
    HBond donors 2
    HBond acceptors 13
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR66022.