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canSAR2018479
FEATURES
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NAMES
    SMILES
    CN(C)C(=O)C1CCC(N2CC(NC(=O)CNc3ncnc4ccc(C(F)(F)F)cc34)C2)CC1
    InChI
    InChI=1S/C23H29F3N6O2/c1-31(2)22(34)14-3-6-17(7-4-14)32-11-16(12-32)30-20(33)10-27-21-18-9-15(23(24,25)26)5-8-19(18)28-13-29-21/h5,8-9,13-14,16-17H,3-4,6-7,10-12H2,1-2H3,(H,30,33)(H,27,28,29)/t14-,17?
    MOLECULAR FORMULA
    C23H29F3N6O2
    CROSS REFERENCES
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    canSAR2018479

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 478.23
    AlogP 2.51
    HBond donors 2
    HBond acceptors 8
    Atoms 63
    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 canSAR2018479.