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canSAR547551
FEATURES
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NAMES
    SMILES
    c1ccc(CN2CCOc3cc(NC4=NCCN4)ccc32)cc1
    InChI
    InChI=1S/C18H20N4O/c1-2-4-14(5-3-1)13-22-10-11-23-17-12-15(6-7-16(17)22)21-18-19-8-9-20-18/h1-7,12H,8-11,13H2,(H2,19,20,21)
    MOLECULAR FORMULA
    C18H20N4O
    CROSS REFERENCES
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    canSAR547551

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 308.16
    AlogP 2.46
    HBond donors 2
    HBond acceptors 5
    Atoms 43
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR547551.