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canSAR1590730
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NAMES
    SMILES
    O=C(/C=C/c1ccc(F)cc1)NCCCn1ccnc1
    InChI
    InChI=1S/C15H16FN3O/c16-14-5-2-13(3-6-14)4-7-15(20)18-8-1-10-19-11-9-17-12-19/h2-7,9,11-12H,1,8,10H2,(H,18,20)/b7-4+
    MOLECULAR FORMULA
    C15H16FN3O
    CROSS REFERENCES
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    canSAR1590730

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 273.13
    AlogP 2.24
    HBond donors 1
    HBond acceptors 4
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1590730.