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canSAR559324
FEATURES
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NAMES
    SMILES
    CN(C)C(=O)[C@@H](c1ccc(-c2ccc3ncnn3c2)cc1)[C@H](N)C(=O)N1CC[C@H](F)C1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C22H25FN6O2.C2HF3O2/c1-27(2)21(30)19(20(24)22(31)28-10-9-17(23)12-28)15-5-3-14(4-6-15)16-7-8-18-25-13-26-29(18)11-16;3-2(4,5)1(6)7/h3-8,11,13,17,19-20H,9-10,12,24H2,1-2H3;(H,6,7)/t17-,19-,20-;/m0./s1
    MOLECULAR FORMULA
    C24H26F4N6O4
    CROSS REFERENCES
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    canSAR559324

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 538.20
    AlogP 2.10
    HBond donors 3
    HBond acceptors 10
    Atoms 64
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR559324.