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canSAR1831923
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NAMES
    SMILES
    Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@H](C)N(C(=O)c1ccc(F)c(C(F)(F)F)c1Cl)C2
    InChI
    InChI=1S/C20H16ClF4N5O/c1-9-7-12-15(27-10(2)28-18(12)14-5-6-26-29-14)8-30(9)19(31)11-3-4-13(22)16(17(11)21)20(23,24)25/h3-6,9H,7-8H2,1-2H3,(H,26,29)/t9-/m0/s1
    MOLECULAR FORMULA
    C20H16ClF4N5O
    CROSS REFERENCES
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    canSAR1831923

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 453.10
    AlogP 4.57
    HBond donors 1
    HBond acceptors 6
    Atoms 47
    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 canSAR1831923.