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canSAR2208954
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NAMES
    SMILES
    O=C(Nc1cccc(C(F)(F)F)c1)Nc1cnc2ccc(N3CCC[C@@H]3c3cc(F)ccc3F)nn12
    InChI
    InChI=1S/C24H19F5N6O/c25-15-6-7-18(26)17(12-15)19-5-2-10-34(19)21-9-8-20-30-13-22(35(20)33-21)32-23(36)31-16-4-1-3-14(11-16)24(27,28)29/h1,3-4,6-9,11-13,19H,2,5,10H2,(H2,31,32,36)/t19-/m1/s1
    MOLECULAR FORMULA
    C24H19F5N6O
    CROSS REFERENCES
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    canSAR2208954

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.15
    AlogP 6.01
    HBond donors 2
    HBond acceptors 7
    Atoms 55
    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 canSAR2208954.