canSAR1746780
FEATURES
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NAMES
    SMILES
    COc1ccccc1-n1c(SCC(=O)N2CCCCC2)nnc1-c1ccccc1O
    InChI
    InChI=1S/C22H24N4O3S/c1-29-19-12-6-4-10-17(19)26-21(16-9-3-5-11-18(16)27)23-24-22(26)30-15-20(28)25-13-7-2-8-14-25/h3-6,9-12,27H,2,7-8,13-15H2,1H3
    MOLECULAR FORMULA
    C22H24N4O3S
    CROSS REFERENCES
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    canSAR1746780
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight424.16
    AlogP3.75
    HBond donors1
    HBond acceptors7
    Atoms54
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746780.