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canSAR2092391
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NAMES
    SMILES
    Nc1ncc(-c2cc(N3CCC3)nc(N3CC[C@H](F)C3)n2)cc1OC(F)F
    InChI
    InChI=1S/C17H19F3N6O/c18-11-2-5-26(9-11)17-23-12(7-14(24-17)25-3-1-4-25)10-6-13(27-16(19)20)15(21)22-8-10/h6-8,11,16H,1-5,9H2,(H2,21,22)/t11-/m0/s1
    MOLECULAR FORMULA
    C17H19F3N6O
    CROSS REFERENCES
    2092391 logo

    canSAR2092391

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.16
    AlogP 2.48
    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 canSAR2092391.