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canSAR1961286
FEATURES
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NAMES
    SMILES
    CCN(c1cc(-c2ccc(CN3CCC(F)CC3)cc2)cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C)C1CCOCC1
    InChI
    InChI=1S/C35H45FN4O3/c1-5-40(30-12-16-43-17-13-30)33-20-28(27-8-6-26(7-9-27)22-39-14-10-29(36)11-15-39)19-31(25(33)4)34(41)37-21-32-23(2)18-24(3)38-35(32)42/h6-9,18-20,29-30H,5,10-17,21-22H2,1-4H3,(H,37,41)(H,38,42)
    MOLECULAR FORMULA
    C35H45FN4O3
    CROSS REFERENCES
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    canSAR1961286

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 588.35
    AlogP 5.84
    HBond donors 2
    HBond acceptors 7
    Atoms 88
    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 canSAR1961286.