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canSAR829343
FEATURES
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NAMES
    SMILES
    CC(=O)Nc1csc(-c2cnc(/C=C(\C)C[C@H]3OC[C@H](C[C@H]4O[C@H]4[C@@H](C)[C@@H](C)O)[C@@H](O)[C@H]3O)o2)c1
    InChI
    InChI=1S/C25H34N2O7S/c1-12(6-22-26-9-20(33-22)21-8-17(11-35-21)27-15(4)29)5-18-24(31)23(30)16(10-32-18)7-19-25(34-19)13(2)14(3)28/h6,8-9,11,13-14,16,18-19,23-25,28,30-31H,5,7,10H2,1-4H3,(H,27,29)
    MOLECULAR FORMULA
    C25H34N2O7S
    CROSS REFERENCES
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    canSAR829343

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 506.21
    AlogP 3.07
    HBond donors 4
    HBond acceptors 9
    Atoms 69
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR829343.