canSAR286409
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)c1cc(C(=O)N[C@H](C)c2ccc(F)cc2)cc(N(C)S(C)(=O)=O)c1)[C@@H](O)C[C@@H](C)C(=O)NN1CCN(Cc2ccccc2)CC1
    InChI
    InChI=1S/C39H53FN6O6S/c1-26(2)20-35(36(47)21-27(3)37(48)43-46-18-16-45(17-19-46)25-29-10-8-7-9-11-29)42-39(50)32-22-31(23-34(24-32)44(5)53(6,51)52)38(49)41-28(4)30-12-14-33(40)15-13-30/h7-15,22-24,26-28,35-36,47H,16-21,25H2,1-6H3,(H,41,49)(H,42,50)(H,43,48)/t27-,28-,35+,36+/m1/s1
    MOLECULAR FORMULA
    C39H53FN6O6S
    CROSS REFERENCES
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    canSAR286409
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight752.37
    AlogP4.09
    HBond donors4
    HBond acceptors12
    Atoms106
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR286409.