canSAR1503142
FEATURES
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NAMES
    SMILES
    CO[C@H]1O[C@H](CNC(=O)CN(C(C)=O)c2ccccc2)[C@@H](OS(=O)(=O)[O-])[C@H](OS(=O)(=O)[O-])[C@@H]1OS(=O)(=O)[O-]
    InChI
    InChI=1S/C17H24N2O16S3/c1-10(20)19(11-6-4-3-5-7-11)9-13(21)18-8-12-14(33-36(22,23)24)15(34-37(25,26)27)16(17(31-2)32-12)35-38(28,29)30/h3-7,12,14-17H,8-9H2,1-2H3,(H,18,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)/p-3/t12-,14-,15+,16+,17+/m1/s1
    MOLECULAR FORMULA
    C17H21N2O16S3-3
    CROSS REFERENCES
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    canSAR1503142
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight605.01
    AlogP-2.94
    HBond donors1
    HBond acceptors18
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1503142.