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canSAR38685
FEATURES
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NAMES
    SMILES
    Cc1cccnc1NCC(P(=O)(O)O)S(=O)(=O)O
    InChI
    InChI=1S/C8H13N2O6PS/c1-6-3-2-4-9-8(6)10-5-7(17(11,12)13)18(14,15)16/h2-4,7H,5H2,1H3,(H,9,10)(H2,11,12,13)(H,14,15,16)
    MOLECULAR FORMULA
    C8H13N2O6PS
    CROSS REFERENCES
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    canSAR38685

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 296.02
    AlogP 0.19
    HBond donors 4
    HBond acceptors 8
    Atoms 31
    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 canSAR38685.