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canSAR65924
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NAMES
    SMILES
    COc1ccc(/C=N/NC(=O)c2nnc3c4c(-c5ccccc5)c(-c5ccccc5)nnc4nn3c2C)cc1
    InChI
    InChI=1S/C29H22N8O2/c1-18-25(29(38)35-30-17-19-13-15-22(39-2)16-14-19)31-34-28-24-23(20-9-5-3-6-10-20)26(21-11-7-4-8-12-21)32-33-27(24)36-37(18)28/h3-17H,1-2H3,(H,35,38)/b30-17+
    MOLECULAR FORMULA
    C29H22N8O2
    CROSS REFERENCES
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    canSAR65924

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 514.19
    AlogP 4.48
    HBond donors 1
    HBond acceptors 10
    Atoms 61
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR65924.