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canSAR784560
FEATURES
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NAMES
    SMILES
    CSC[S+]([O-])C[C@H](C)NC(=O)/C=C/c1c(C)nc(O)nc1O
    InChI
    InChI=1S/C13H19N3O4S2/c1-8(6-22(20)7-21-3)14-11(17)5-4-10-9(2)15-13(19)16-12(10)18/h4-5,8H,6-7H2,1-3H3,(H,14,17)(H2,15,16,18,19)/b5-4+/t8-,22?/m0/s1
    MOLECULAR FORMULA
    C13H19N3O4S2
    CROSS REFERENCES
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    canSAR784560

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 345.08
    AlogP 0.78
    HBond donors 3
    HBond acceptors 7
    Atoms 41
    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 canSAR784560.