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canSAR1445235
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NAMES
    SMILES
    CCN(CC)CCCn1c2c(c(SCC(=O)Nc3ccc4c(c3)OCO4)nc1=O)CCC2
    InChI
    InChI=1S/C23H30N4O4S/c1-3-26(4-2)11-6-12-27-18-8-5-7-17(18)22(25-23(27)29)32-14-21(28)24-16-9-10-19-20(13-16)31-15-30-19/h9-10,13H,3-8,11-12,14-15H2,1-2H3,(H,24,28)
    MOLECULAR FORMULA
    C23H30N4O4S
    CROSS REFERENCES
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    canSAR1445235

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.20
    AlogP 2.92
    HBond donors 1
    HBond acceptors 8
    Atoms 62
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1445235.