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canSAR1591666
FEATURES
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NAMES
    SMILES
    O=C1NC(=O)N(c2cccc3ccccc23)C(=O)/C1=C/NNC(=O)c1ccncc1
    InChI
    InChI=1S/C21H15N5O4/c27-18(14-8-10-22-11-9-14)25-23-12-16-19(28)24-21(30)26(20(16)29)17-7-3-5-13-4-1-2-6-15(13)17/h1-12,23H,(H,25,27)(H,24,28,30)/b16-12+
    MOLECULAR FORMULA
    C21H15N5O4
    CROSS REFERENCES
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    canSAR1591666

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.11
    AlogP 1.64
    HBond donors 3
    HBond acceptors 9
    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 canSAR1591666.