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canSAR1725543
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NAMES
    SMILES
    COCCOc1cnc(Nc2ccc([C@@H]3CNCCO3)cc2F)nc1
    InChI
    InChI=1S/C17H21FN4O3/c1-23-6-7-24-13-9-20-17(21-10-13)22-15-3-2-12(8-14(15)18)16-11-19-4-5-25-16/h2-3,8-10,16,19H,4-7,11H2,1H3,(H,20,21,22)/t16-/m0/s1
    MOLECULAR FORMULA
    C17H21FN4O3
    CROSS REFERENCES
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    canSAR1725543

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.16
    AlogP 2.05
    HBond donors 2
    HBond acceptors 7
    Atoms 46
    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 canSAR1725543.