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canSAR672479
FEATURES
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NAMES
    SMILES
    CC1(C)Cc2nc(C3CCCC3)c(C(=O)c3ccc(C(F)(F)F)cc3)c(C3CCCCC3)c2[C@@H](O)C1
    InChI
    InChI=1S/C30H36F3NO2/c1-29(2)16-22-25(23(35)17-29)24(18-8-4-3-5-9-18)26(27(34-22)19-10-6-7-11-19)28(36)20-12-14-21(15-13-20)30(31,32)33/h12-15,18-19,23,35H,3-11,16-17H2,1-2H3/t23-/m0/s1
    MOLECULAR FORMULA
    C30H36F3NO2
    CROSS REFERENCES
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    canSAR672479

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 499.27
    AlogP 8.04
    HBond donors 1
    HBond acceptors 3
    Atoms 72
    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 canSAR672479.