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canSAR1617453
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NAMES
    SMILES
    CCN(C)c1nccc2ccc(C(=O)N3CCC4(CC3)Cc3cn(C(C)(C)C)nc3C(=O)N4)cc12
    InChI
    InChI=1S/C27H34N6O2/c1-6-31(5)23-21-15-19(8-7-18(21)9-12-28-23)25(35)32-13-10-27(11-14-32)16-20-17-33(26(2,3)4)30-22(20)24(34)29-27/h7-9,12,15,17H,6,10-11,13-14,16H2,1-5H3,(H,29,34)
    MOLECULAR FORMULA
    C27H34N6O2
    CROSS REFERENCES
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    canSAR1617453

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 474.27
    AlogP 3.60
    HBond donors 1
    HBond acceptors 8
    Atoms 69
    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 canSAR1617453.