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canSAR144558
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NAMES
    SMILES
    C[C@H]1CN(Cc2cccc(-c3cc(CNC(=O)c4cccc(CN5CCN(CCCO)CC5)c4)ccc3F)c2)CCN1
    InChI
    InChI=1S/C34H44FN5O2/c1-26-23-40(13-11-36-26)25-28-5-2-7-30(19-28)32-21-27(9-10-33(32)35)22-37-34(42)31-8-3-6-29(20-31)24-39-16-14-38(15-17-39)12-4-18-41/h2-3,5-10,19-21,26,36,41H,4,11-18,22-25H2,1H3,(H,37,42)/t26-/m0/s1
    MOLECULAR FORMULA
    C34H44FN5O2
    CROSS REFERENCES
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    canSAR144558

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 573.35
    AlogP 3.72
    HBond donors 3
    HBond acceptors 7
    Atoms 86
    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 canSAR144558.