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canSAR1991179
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H](C)c1ccc(O[C@@H]2CCN(c3nc(N(C)CC(F)F)ncc3F)C2)cc1
    InChI
    InChI=1S/C21H26F3N5O2/c1-13(26-14(2)30)15-4-6-16(7-5-15)31-17-8-9-29(11-17)20-18(22)10-25-21(27-20)28(3)12-19(23)24/h4-7,10,13,17,19H,8-9,11-12H2,1-3H3,(H,26,30)/t13-,17+/m0/s1
    MOLECULAR FORMULA
    C21H26F3N5O2
    CROSS REFERENCES
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    canSAR1991179

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.20
    AlogP 3.17
    HBond donors 1
    HBond acceptors 7
    Atoms 57
    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 canSAR1991179.