canSAR415346
FEATURES
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NAMES
    SMILES
    CCN1C(=O)N(c2ccc(N3CCN(c4ccc(OC[C@@H]5CO[C@@](Cn6cncn6)(c6ccc(F)cc6F)O5)cc4)CC3)cc2)C(=O)C(C)(C)C1=O
    InChI
    InChI=1S/C37H39F2N7O6/c1-4-45-33(47)36(2,3)34(48)46(35(45)49)28-8-6-26(7-9-28)42-15-17-43(18-16-42)27-10-12-29(13-11-27)50-20-30-21-51-37(52-30,22-44-24-40-23-41-44)31-14-5-25(38)19-32(31)39/h5-14,19,23-24,30H,4,15-18,20-22H2,1-3H3/t30-,37-/m1/s1
    MOLECULAR FORMULA
    C37H39F2N7O6
    CROSS REFERENCES
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    canSAR415346
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight715.29
    AlogP4.57
    HBond donors0
    HBond acceptors13
    Atoms91
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR415346.