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canSAR2205816
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NAMES
    SMILES
    CC(=O)c1nn(CC(=O)N2[C@H](C(=O)NC3CC(F)(F)C3)C[C@H]3C[C@H]32)c2ccc(OCc3ncccn3)cc12
    InChI
    InChI=1S/C26H26F2N6O4/c1-14(35)24-18-9-17(38-13-22-29-5-2-6-30-22)3-4-19(18)33(32-24)12-23(36)34-20-7-15(20)8-21(34)25(37)31-16-10-26(27,28)11-16/h2-6,9,15-16,20-21H,7-8,10-13H2,1H3,(H,31,37)/t15-,20-,21+/m1/s1
    MOLECULAR FORMULA
    C26H26F2N6O4
    CROSS REFERENCES
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    canSAR2205816

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 524.20
    AlogP 2.51
    HBond donors 1
    HBond acceptors 10
    Atoms 64
    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 canSAR2205816.