canSAR1417357
FEATURES
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NAMES
    SMILES
    COc1cc(C(=O)NCc2nnc(SCC(=O)NCc3ccccc3)o2)cc(OC)c1OC
    InChI
    InChI=1S/C22H24N4O6S/c1-29-16-9-15(10-17(30-2)20(16)31-3)21(28)24-12-19-25-26-22(32-19)33-13-18(27)23-11-14-7-5-4-6-8-14/h4-10H,11-13H2,1-3H3,(H,23,27)(H,24,28)
    MOLECULAR FORMULA
    C22H24N4O6S
    CROSS REFERENCES
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    canSAR1417357
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight472.14
    AlogP2.43
    HBond donors2
    HBond acceptors10
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417357.