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canSAR1407919
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NAMES
    SMILES
    COc1cnc2c(Nc3ccc(F)c([C@]4(C)N=C(N)O[C@@H]5C[C@@H]54)c3)nccc2c1
    InChI
    InChI=1S/C21H20FN5O2/c1-21(15-9-17(15)29-20(23)27-21)14-8-12(3-4-16(14)22)26-19-18-11(5-6-24-19)7-13(28-2)10-25-18/h3-8,10,15,17H,9H2,1-2H3,(H2,23,27)(H,24,26)/t15-,17+,21-/m0/s1
    MOLECULAR FORMULA
    C21H20FN5O2
    CROSS REFERENCES
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    canSAR1407919

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.16
    AlogP 3.47
    HBond donors 3
    HBond acceptors 7
    Atoms 49
    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 canSAR1407919.