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canSAR1024633
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NAMES
    SMILES
    O=C([C@@H]1CNC[C@H]1c1ccc(F)cc1F)N1CCC(c2ccnn2-c2ccc(F)c(Cl)c2)CC1
    InChI
    InChI=1S/C25H24ClF3N4O/c26-21-12-17(2-4-22(21)28)33-24(5-8-31-33)15-6-9-32(10-7-15)25(34)20-14-30-13-19(20)18-3-1-16(27)11-23(18)29/h1-5,8,11-12,15,19-20,30H,6-7,9-10,13-14H2/t19-,20+/m0/s1
    MOLECULAR FORMULA
    C25H24ClF3N4O
    CROSS REFERENCES
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    canSAR1024633

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.16
    AlogP 4.65
    HBond donors 1
    HBond acceptors 5
    Atoms 58
    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 canSAR1024633.