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canSAR1688271
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NAMES
    SMILES
    COc1ccc(Nc2ncc(CO)cc2-c2nc(C)nc3[nH]cnc23)cn1
    InChI
    InChI=1S/C18H17N7O2/c1-10-23-15(16-18(24-10)22-9-21-16)13-5-11(8-26)6-20-17(13)25-12-3-4-14(27-2)19-7-12/h3-7,9,26H,8H2,1-2H3,(H,20,25)(H,21,22,23,24)
    MOLECULAR FORMULA
    C18H17N7O2
    CROSS REFERENCES
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    canSAR1688271

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.14
    AlogP 2.36
    HBond donors 3
    HBond acceptors 9
    Atoms 44
    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 canSAR1688271.