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canSAR2016269
FEATURES
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NAMES
    SMILES
    N=C(N)c1ccc(OC(=O)c2ccc(-c3cccc(C(=O)N[C@@H](CC(=O)O)C(=O)O)c3)s2)cc1
    InChI
    InChI=1S/C23H19N3O7S/c24-20(25)12-4-6-15(7-5-12)33-23(32)18-9-8-17(34-18)13-2-1-3-14(10-13)21(29)26-16(22(30)31)11-19(27)28/h1-10,16H,11H2,(H3,24,25)(H,26,29)(H,27,28)(H,30,31)/t16-/m0/s1
    MOLECULAR FORMULA
    C23H19N3O7S
    CROSS REFERENCES
    2016269 logo

    canSAR2016269

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 481.09
    AlogP 2.58
    HBond donors 6
    HBond acceptors 10
    Atoms 53
    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 canSAR2016269.