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canSAR785434
FEATURES
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NAMES
    SMILES
    COC1OC(CSC2(C(=O)O)CC(O)C(NC(C)=O)C([C@H](O)[C@H](O)CO)O2)C(O)C(O)C1O
    InChI
    InChI=1S/C18H31NO13S/c1-6(21)19-10-7(22)3-18(17(28)29,32-15(10)11(24)8(23)4-20)33-5-9-12(25)13(26)14(27)16(30-2)31-9/h7-16,20,22-27H,3-5H2,1-2H3,(H,19,21)(H,28,29)/t7?,8-,9?,10?,11-,12?,13?,14?,15?,16?,18?/m1/s1
    MOLECULAR FORMULA
    C18H31NO13S
    CROSS REFERENCES
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    canSAR785434

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 501.15
    AlogP -4.68
    HBond donors 9
    HBond acceptors 14
    Atoms 64
    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 canSAR785434.