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canSAR1590629
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NAMES
    SMILES
    Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)cc(C#N)n1
    InChI
    InChI=1S/C18H17FN4O2/c1-11-6-13(7-14(9-20)22-11)18(24)23-16-3-2-12(8-15(16)19)17-10-21-4-5-25-17/h2-3,6-8,17,21H,4-5,10H2,1H3,(H,23,24)/t17-/m1/s1
    MOLECULAR FORMULA
    C18H17FN4O2
    CROSS REFERENCES
    1590629 logo

    canSAR1590629

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 340.13
    AlogP 2.31
    HBond donors 2
    HBond acceptors 6
    Atoms 42
    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 canSAR1590629.