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canSAR1067102
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)CS(=O)(=O)F)[C@@H](C)OCc1ccccc1
    InChI
    InChI=1S/C28H46FN3O7S/c1-9-19(4)23(32-27(35)39-28(6,7)8)25(33)31-24(20(5)38-16-21-13-11-10-12-14-21)26(34)30-22(15-18(2)3)17-40(29,36)37/h10-14,18-20,22-24H,9,15-17H2,1-8H3,(H,30,34)(H,31,33)(H,32,35)/t19-,20+,22-,23-,24-/m0/s1
    MOLECULAR FORMULA
    C28H46FN3O7S
    CROSS REFERENCES
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    canSAR1067102

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 587.30
    AlogP 3.85
    HBond donors 3
    HBond acceptors 10
    Atoms 86
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1067102.