canSAR1417546
FEATURES
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NAMES
    SMILES
    COc1ccccc1N1CCN(C(=O)c2cc3c(=O)oc4ccccc4c3s2)CC1
    InChI
    InChI=1S/C23H20N2O4S/c1-28-19-9-5-3-7-17(19)24-10-12-25(13-11-24)22(26)20-14-16-21(30-20)15-6-2-4-8-18(15)29-23(16)27/h2-9,14H,10-13H2,1H3
    MOLECULAR FORMULA
    C23H20N2O4S
    CROSS REFERENCES
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    canSAR1417546
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight420.11
    AlogP3.98
    HBond donors0
    HBond acceptors6
    Atoms50
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417546.