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canSAR781160
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NAMES
    SMILES
    Oc1ccc(-c2cc(Nc3ccc4[nH]ncc4c3)nc(N3CCOCC3)n2)cc1
    InChI
    InChI=1S/C21H20N6O2/c28-17-4-1-14(2-5-17)19-12-20(25-21(24-19)27-7-9-29-10-8-27)23-16-3-6-18-15(11-16)13-22-26-18/h1-6,11-13,28H,7-10H2,(H,22,26)(H,23,24,25)
    MOLECULAR FORMULA
    C21H20N6O2
    CROSS REFERENCES
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    canSAR781160

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 388.16
    AlogP 3.31
    HBond donors 3
    HBond acceptors 8
    Atoms 49
    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 canSAR781160.