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canSAR1859882
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NAMES
    SMILES
    O=S(=O)(Nc1ccncn1)c1ccc2c(OCc3ccc(N4CCOCC4)cc3)nccc2c1
    InChI
    InChI=1S/C24H23N5O4S/c30-34(31,28-23-8-9-25-17-27-23)21-5-6-22-19(15-21)7-10-26-24(22)33-16-18-1-3-20(4-2-18)29-11-13-32-14-12-29/h1-10,15,17H,11-14,16H2,(H,25,27,28)
    MOLECULAR FORMULA
    C24H23N5O4S
    CROSS REFERENCES
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    canSAR1859882

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.15
    AlogP 3.24
    HBond donors 1
    HBond acceptors 9
    Atoms 57
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1859882.