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canSAR1863110
FEATURES
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NAMES
    SMILES
    C[C@@H](NC(=O)N1CCc2cnc(N[C@H]3CCC(F)(F)C3)nc2C1)c1ccc(Cl)c(Cl)c1
    InChI
    InChI=1S/C21H23Cl2F2N5O/c1-12(13-2-3-16(22)17(23)8-13)27-20(31)30-7-5-14-10-26-19(29-18(14)11-30)28-15-4-6-21(24,25)9-15/h2-3,8,10,12,15H,4-7,9,11H2,1H3,(H,27,31)(H,26,28,29)/t12-,15+/m1/s1
    MOLECULAR FORMULA
    C21H23Cl2F2N5O
    CROSS REFERENCES
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    canSAR1863110

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 469.12
    AlogP 5.21
    HBond donors 2
    HBond acceptors 6
    Atoms 54
    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 canSAR1863110.