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canSAR1592042
FEATURES
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NAMES
    SMILES
    CC(C)(C)OC(=O)N/N=C/c1cc(N=Nc2ccccc2)ccc1O
    InChI
    InChI=1S/C18H20N4O3/c1-18(2,3)25-17(24)22-19-12-13-11-15(9-10-16(13)23)21-20-14-7-5-4-6-8-14/h4-12,23H,1-3H3,(H,22,24)/b19-12+,21-20?
    MOLECULAR FORMULA
    C18H20N4O3
    CROSS REFERENCES
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    canSAR1592042

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 340.15
    AlogP 4.67
    HBond donors 2
    HBond acceptors 7
    Atoms 45
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1592042.