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canSAR1100387
FEATURES
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NAMES
    SMILES
    c1ccc2sc(Oc3ccc4cc(CN5CCCCC5)oc4c3)nc2c1
    InChI
    InChI=1S/C21H20N2O2S/c1-4-10-23(11-5-1)14-17-12-15-8-9-16(13-19(15)24-17)25-21-22-18-6-2-3-7-20(18)26-21/h2-3,6-9,12-13H,1,4-5,10-11,14H2
    MOLECULAR FORMULA
    C21H20N2O2S
    CROSS REFERENCES
    1100387 logo

    canSAR1100387

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 364.12
    AlogP 5.82
    HBond donors 0
    HBond acceptors 4
    Atoms 46
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1100387.