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canSAR1017824
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NAMES
    SMILES
    Cc1nc(C2CCN(C(=O)[C@@H]3CNC[C@H]3c3ccc(F)cc3F)CC2)n(-c2ccc(F)c(Cl)c2)n1
    InChI
    InChI=1S/C25H25ClF3N5O/c1-14-31-24(34(32-14)17-3-5-22(28)21(26)11-17)15-6-8-33(9-7-15)25(35)20-13-30-12-19(20)18-4-2-16(27)10-23(18)29/h2-5,10-11,15,19-20,30H,6-9,12-13H2,1H3/t19-,20+/m0/s1
    MOLECULAR FORMULA
    C25H25ClF3N5O
    CROSS REFERENCES
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    canSAR1017824

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 503.17
    AlogP 4.36
    HBond donors 1
    HBond acceptors 6
    Atoms 60
    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 canSAR1017824.