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canSAR350743
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NAMES
    SMILES
    Cc1nn(C)c2ncc(C(=O)N[C@H](C)[C@](O)(Cn3cncn3)c3ccc(F)cc3F)c(Cl)c12
    InChI
    InChI=1S/C21H20ClF2N7O2/c1-11-17-18(22)14(7-26-19(17)30(3)29-11)20(32)28-12(2)21(33,8-31-10-25-9-27-31)15-5-4-13(23)6-16(15)24/h4-7,9-10,12,33H,8H2,1-3H3,(H,28,32)/t12-,21-/m1/s1
    MOLECULAR FORMULA
    C21H20ClF2N7O2
    CROSS REFERENCES
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    canSAR350743

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.13
    AlogP 2.51
    HBond donors 2
    HBond acceptors 9
    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 canSAR350743.