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canSAR1147307
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NAMES
    SMILES
    COc1ccc2c(c1)CCCN(C1CCN(C(=O)C3(F)CCN(Cc4ccnc(N)c4)CC3)CC1)C2
    InChI
    InChI=1S/C28H38FN5O2/c1-36-25-5-4-23-20-34(12-2-3-22(23)18-25)24-7-13-33(14-8-24)27(35)28(29)9-15-32(16-10-28)19-21-6-11-31-26(30)17-21/h4-6,11,17-18,24H,2-3,7-10,12-16,19-20H2,1H3,(H2,30,31)
    MOLECULAR FORMULA
    C28H38FN5O2
    CROSS REFERENCES
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    canSAR1147307

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 495.30
    AlogP 3.42
    HBond donors 2
    HBond acceptors 7
    Atoms 74
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1147307.