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canSAR1126001
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NAMES
    SMILES
    COc1cc2nnc(C(N)=O)c(Nc3ccc(C)cc3F)c2cc1N1CCC(OC)CC1
    InChI
    InChI=1S/C23H26FN5O3/c1-13-4-5-17(16(24)10-13)26-21-15-11-19(29-8-6-14(31-2)7-9-29)20(32-3)12-18(15)27-28-22(21)23(25)30/h4-5,10-12,14H,6-9H2,1-3H3,(H2,25,30)(H,26,27)
    MOLECULAR FORMULA
    C23H26FN5O3
    CROSS REFERENCES
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    canSAR1126001

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.20
    AlogP 3.54
    HBond donors 3
    HBond acceptors 8
    Atoms 58
    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 canSAR1126001.