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canSAR558380
FEATURES
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NAMES
    SMILES
    O=P(O)(O)CS(=O)(=O)NCCCc1cccc(Oc2ccccc2)c1
    InChI
    InChI=1S/C16H20NO6PS/c18-24(19,20)13-25(21,22)17-11-5-7-14-6-4-10-16(12-14)23-15-8-2-1-3-9-15/h1-4,6,8-10,12,17H,5,7,11,13H2,(H2,18,19,20)
    MOLECULAR FORMULA
    C16H20NO6PS
    CROSS REFERENCES
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    canSAR558380

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.07
    AlogP 2.47
    HBond donors 3
    HBond acceptors 7
    Atoms 45
    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 canSAR558380.