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canSAR1690948
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NAMES
    SMILES
    Cc1ccc(-n2cc(CN3CCN(Cc4nccn4C)CC3)c(-c3ccc(F)cc3)n2)cc1
    InChI
    InChI=1S/C26H29FN6/c1-20-3-9-24(10-4-20)33-18-22(26(29-33)21-5-7-23(27)8-6-21)17-31-13-15-32(16-14-31)19-25-28-11-12-30(25)2/h3-12,18H,13-17,19H2,1-2H3
    MOLECULAR FORMULA
    C26H29FN6
    CROSS REFERENCES
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    canSAR1690948

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.24
    AlogP 4.04
    HBond donors 0
    HBond acceptors 6
    Atoms 62
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1690948.