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canSAR2093515
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NAMES
    SMILES
    N#Cc1cc2nc(N3CCC([C@H](F)c4ccc(F)cc4F)CC3)c(NC3CC3)nc2cn1
    InChI
    InChI=1S/C23H21F3N6/c24-14-1-4-17(18(25)9-14)21(26)13-5-7-32(8-6-13)23-22(29-15-2-3-15)30-20-12-28-16(11-27)10-19(20)31-23/h1,4,9-10,12-13,15,21H,2-3,5-8H2,(H,29,30)/t21-/m0/s1
    MOLECULAR FORMULA
    C23H21F3N6
    CROSS REFERENCES
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    canSAR2093515

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.18
    AlogP 4.68
    HBond donors 1
    HBond acceptors 6
    Atoms 53
    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 canSAR2093515.