canSAR418142
FEATURES
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NAMES
    SMILES
    CN(C)C(=O)Oc1ccc(C[C@H](NC(=O)[C@H]2N(S(=O)(=O)c3ccn(C)n3)CSC2(C)C)C(=O)OCOC(=O)C(C)(C)C)cc1
    InChI
    InChI=1S/C28H39N5O9S2/c1-27(2,3)25(36)41-17-40-24(35)20(15-18-9-11-19(12-10-18)42-26(37)31(6)7)29-23(34)22-28(4,5)43-16-33(22)44(38,39)21-13-14-32(8)30-21/h9-14,20,22H,15-17H2,1-8H3,(H,29,34)/t20-,22+/m0/s1
    MOLECULAR FORMULA
    C28H39N5O9S2
    CROSS REFERENCES
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    canSAR418142
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight653.22
    AlogP2.14
    HBond donors1
    HBond acceptors14
    Atoms83
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR418142.