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canSAR1634276
FEATURES
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NAMES
    SMILES
    C[C@H]1CN([C@H](C)CO)C(=O)c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2O[C@H](C)CCCCO[C@H]1CN(C)S(=O)(=O)c1ccccc1
    InChI
    InChI=1S/C34H44FN3O8S2/c1-24-21-38(25(2)23-39)34(40)31-20-28(36-47(41,42)29-16-13-27(35)14-17-29)15-18-32(31)46-26(3)10-8-9-19-45-33(24)22-37(4)48(43,44)30-11-6-5-7-12-30/h5-7,11-18,20,24-26,33,36,39H,8-10,19,21-23H2,1-4H3/t24-,25+,26+,33-/m0/s1
    MOLECULAR FORMULA
    C34H44FN3O8S2
    CROSS REFERENCES
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    canSAR1634276

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 705.26
    AlogP 4.74
    HBond donors 2
    HBond acceptors 11
    Atoms 92
    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 canSAR1634276.