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canSAR1152154
FEATURES
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NAMES
    SMILES
    C/C(=C\c1ccc(N(C)C)cc1)C(=O)N[C@@H]1[C@H](O)[C@@H](O)[C@H]2OC(OC(C(=O)O)C(O)CO)O[C@H]2[C@@H]1N(C)C
    InChI
    InChI=1S/C25H37N3O10/c1-12(10-13-6-8-14(9-7-13)27(2)3)23(33)26-16-17(28(4)5)21-22(19(32)18(16)31)38-25(37-21)36-20(24(34)35)15(30)11-29/h6-10,15-22,25,29-32H,11H2,1-5H3,(H,26,33)(H,34,35)/b12-10+/t15?,16-,17+,18-,19+,20?,21-,22+,25?/m0/s1
    MOLECULAR FORMULA
    C25H37N3O10
    CROSS REFERENCES
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    canSAR1152154

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 539.25
    AlogP -1.80
    HBond donors 6
    HBond acceptors 13
    Atoms 75
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1152154.