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canSAR1023677
FEATURES
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NAMES
    SMILES
    Cn1cc(Nc2ncc(C(F)(F)F)c(N[C@H]3[C@@H](C(=O)NCCO)[C@@H]4C=C[C@H]3C4)n2)cn1
    InChI
    InChI=1S/C19H22F3N7O2/c1-29-9-12(7-25-29)26-18-24-8-13(19(20,21)22)16(28-18)27-15-11-3-2-10(6-11)14(15)17(31)23-4-5-30/h2-3,7-11,14-15,30H,4-6H2,1H3,(H,23,31)(H2,24,26,27,28)/t10-,11+,14+,15-/m1/s1
    MOLECULAR FORMULA
    C19H22F3N7O2
    CROSS REFERENCES
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    canSAR1023677

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.18
    AlogP 1.68
    HBond donors 4
    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 canSAR1023677.