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canSAR1617759
FEATURES
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NAMES
    SMILES
    CN(C)C(=O)[C@@H](c1ccc(-c2ccc3nncn3c2)cc1)[C@H]([NH3+])C(=O)N1CC[C@H](F)C1
    InChI
    InChI=1S/C22H25FN6O2/c1-27(2)21(30)19(20(24)22(31)28-10-9-17(23)12-28)15-5-3-14(4-6-15)16-7-8-18-26-25-13-29(18)11-16/h3-8,11,13,17,19-20H,9-10,12,24H2,1-2H3/p+1/t17-,19-,20-/m0/s1
    MOLECULAR FORMULA
    C22H26FN6O2+
    CROSS REFERENCES
    1617759 logo

    canSAR1617759

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.21
    AlogP 0.75
    HBond donors 3
    HBond acceptors 8
    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 canSAR1617759.