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canSAR1620276
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NAMES
    SMILES
    CCN(CC)c1ccc(C(=O)NCc2ccc3c(c2)CCN3C(=O)c2ccc(F)cc2)cc1
    InChI
    InChI=1S/C27H28FN3O2/c1-3-30(4-2)24-12-8-20(9-13-24)26(32)29-18-19-5-14-25-22(17-19)15-16-31(25)27(33)21-6-10-23(28)11-7-21/h5-14,17H,3-4,15-16,18H2,1-2H3,(H,29,32)
    MOLECULAR FORMULA
    C27H28FN3O2
    CROSS REFERENCES
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    canSAR1620276

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 445.22
    AlogP 4.80
    HBond donors 1
    HBond acceptors 5
    Atoms 61
    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 canSAR1620276.