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canSAR828873
FEATURES
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NAMES
    SMILES
    CC(C)[C@H](NC(=O)CCC(O)(Cc1ccccc1)C(=O)Nc1cc(C(=O)N[C@H](C)c2ccc(F)cc2)cc(N(C)S(C)(=O)=O)c1)C(=O)NCc1ccccc1
    InChI
    InChI=1S/C41H48FN5O7S/c1-27(2)37(39(50)43-26-30-14-10-7-11-15-30)46-36(48)20-21-41(52,25-29-12-8-6-9-13-29)40(51)45-34-22-32(23-35(24-34)47(4)55(5,53)54)38(49)44-28(3)31-16-18-33(42)19-17-31/h6-19,22-24,27-28,37,52H,20-21,25-26H2,1-5H3,(H,43,50)(H,44,49)(H,45,51)(H,46,48)/t28-,37+,41?/m1/s1
    MOLECULAR FORMULA
    C41H48FN5O7S
    CROSS REFERENCES
    828873 logo

    canSAR828873

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 773.33
    AlogP 4.86
    HBond donors 5
    HBond acceptors 12
    Atoms 103
    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 canSAR828873.