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canSAR1204818
FEATURES
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NAMES
    SMILES
    Cc1cc(C)cc(-c2n[nH]c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)n2)c1
    InChI
    InChI=1S/C16H21N3O5/c1-7-3-8(2)5-9(4-7)15-17-16(19-18-15)14-13(23)12(22)11(21)10(6-20)24-14/h3-5,10-14,20-23H,6H2,1-2H3,(H,17,18,19)/t10-,11-,12+,13-,14-/m1/s1
    MOLECULAR FORMULA
    C16H21N3O5
    CROSS REFERENCES
    1204818 logo

    canSAR1204818

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 335.15
    AlogP -0.40
    HBond donors 5
    HBond acceptors 8
    Atoms 45
    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 canSAR1204818.