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canSAR784851
FEATURES
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NAMES
    SMILES
    CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1ccccc1c2/C=N/OCC1O[C@H](O)C(O)[C@H](O)[C@H]1O
    InChI
    InChI=1S/C27H27N3O10/c1-2-27(37)16-7-18-20-14(9-30(18)24(34)15(16)10-38-26(27)36)13(12-5-3-4-6-17(12)29-20)8-28-39-11-19-21(31)22(32)23(33)25(35)40-19/h3-8,19,21-23,25,31-33,35,37H,2,9-11H2,1H3/b28-8+/t19?,21-,22+,23?,25-,27-/m0/s1
    MOLECULAR FORMULA
    C27H27N3O10
    CROSS REFERENCES
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    canSAR784851

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 553.17
    AlogP -0.77
    HBond donors 5
    HBond acceptors 13
    Atoms 67
    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 canSAR784851.