canSAR108771
FEATURES
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NAMES
    SMILES
    CN(C)c1cc(NC(=O)c2cccs2)c(O)c2c1CC1CC3[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]3(O)C(=O)C1=C2O
    InChI
    InChI=1S/C28H30N4O8S/c1-31(2)15-10-14(30-27(39)16-6-5-7-41-16)21(33)18-12(15)8-11-9-13-20(32(3)4)23(35)19(26(29)38)25(37)28(13,40)24(36)17(11)22(18)34/h5-7,10-11,13,20,33-34,37,40H,8-9H2,1-4H3,(H2,29,38)(H,30,39)/t11?,13?,20-,28-/m0/s1
    MOLECULAR FORMULA
    C28H30N4O8S
    CROSS REFERENCES
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    canSAR108771
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight582.18
    AlogP1.34
    HBond donors7
    HBond acceptors12
    Atoms71
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR108771.