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canSAR1834068
FEATURES
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NAMES
    SMILES
    CC(C)NC(=O)Nc1cccc2c1O[C@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@H](C)CO)C2=O
    InChI
    InChI=1S/C21H34N4O6S/c1-13(2)22-21(28)23-17-9-7-8-16-19(17)31-18(11-24(5)32(6,29)30)14(3)10-25(20(16)27)15(4)12-26/h7-9,13-15,18,26H,10-12H2,1-6H3,(H2,22,23,28)/t14-,15+,18+/m0/s1
    MOLECULAR FORMULA
    C21H34N4O6S
    CROSS REFERENCES
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    canSAR1834068

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.22
    AlogP 1.33
    HBond donors 3
    HBond acceptors 10
    Atoms 66
    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 canSAR1834068.