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canSAR927963
FEATURES
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NAMES
    SMILES
    C[C@@H](C[C@@](C)(CS(=O)(=O)N1CCC(CCc2cc(F)ccc2Cl)CC1)N(O)C=O)c1ncc(F)cn1
    InChI
    InChI=1S/C24H31ClF2N4O4S/c1-17(23-28-13-21(27)14-29-23)12-24(2,31(33)16-32)15-36(34,35)30-9-7-18(8-10-30)3-4-19-11-20(26)5-6-22(19)25/h5-6,11,13-14,16-18,33H,3-4,7-10,12,15H2,1-2H3/t17-,24-/m0/s1
    MOLECULAR FORMULA
    C24H31ClF2N4O4S
    CROSS REFERENCES
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    canSAR927963

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 544.17
    AlogP 4.18
    HBond donors 1
    HBond acceptors 8
    Atoms 67
    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 canSAR927963.