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canSAR2052357
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NAMES
    SMILES
    CC(=O)c1cccc(-c2cnc3cnc(-c4ccc(C(=O)NCCN(C)C)cc4)cn23)c1
    InChI
    InChI=1S/C25H25N5O2/c1-17(31)20-5-4-6-21(13-20)23-14-28-24-15-27-22(16-30(23)24)18-7-9-19(10-8-18)25(32)26-11-12-29(2)3/h4-10,13-16H,11-12H2,1-3H3,(H,26,32)
    MOLECULAR FORMULA
    C25H25N5O2
    CROSS REFERENCES
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    canSAR2052357

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.20
    AlogP 3.56
    HBond donors 1
    HBond acceptors 7
    Atoms 57
    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 canSAR2052357.