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canSAR1638859
FEATURES
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NAMES
    SMILES
    O=C(CCN1CCN(C/C=C/c2ccccc2)CC1)Nc1ccccc1F.O=C(O)C(=O)O
    InChI
    InChI=1S/C22H26FN3O.C2H2O4/c23-20-10-4-5-11-21(20)24-22(27)12-14-26-17-15-25(16-18-26)13-6-9-19-7-2-1-3-8-19;3-1(4)2(5)6/h1-11H,12-18H2,(H,24,27);(H,3,4)(H,5,6)/b9-6+;
    MOLECULAR FORMULA
    C24H28FN3O5
    CROSS REFERENCES
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    canSAR1638859

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.20
    AlogP 2.64
    HBond donors 3
    HBond acceptors 8
    Atoms 61
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1638859.