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canSAR783297
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NAMES
    SMILES
    COc1cc2nc(N3CCN(C(=O)c4ccccc4)[C@H]4CCCC[C@H]43)nc(N)c2cc1OC
    InChI
    InChI=1S/C25H29N5O3/c1-32-21-14-17-18(15-22(21)33-2)27-25(28-23(17)26)30-13-12-29(19-10-6-7-11-20(19)30)24(31)16-8-4-3-5-9-16/h3-5,8-9,14-15,19-20H,6-7,10-13H2,1-2H3,(H2,26,27,28)/t19-,20+/m0/s1
    MOLECULAR FORMULA
    C25H29N5O3
    CROSS REFERENCES
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    canSAR783297

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 447.23
    AlogP 3.50
    HBond donors 2
    HBond acceptors 8
    Atoms 62
    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 canSAR783297.