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canSAR1525452
FEATURES
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NAMES
    SMILES
    CCOc1cc(/C=N/NC(=O)CCc2nnc(O)nc2O)ccc1O
    InChI
    InChI=1S/C15H17N5O5/c1-2-25-12-7-9(3-5-11(12)21)8-16-19-13(22)6-4-10-14(23)17-15(24)20-18-10/h3,5,7-8,21H,2,4,6H2,1H3,(H,19,22)(H2,17,20,23,24)/b16-8+
    MOLECULAR FORMULA
    C15H17N5O5
    CROSS REFERENCES
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    canSAR1525452

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 347.12
    AlogP 0.47
    HBond donors 4
    HBond acceptors 10
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1525452.