canSAR2168836
FEATURES
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NAMES
    SMILES
    COc1nccc2oc(-c3cnc4ccc(OCCCS(C)(=O)=NC#N)nn34)cc12
    InChI
    InChI=1S/C19H18N6O4S/c1-27-19-13-10-16(29-15(13)6-7-21-19)14-11-22-17-4-5-18(24-25(14)17)28-8-3-9-30(2,26)23-12-20/h4-7,10-11H,3,8-9H2,1-2H3
    MOLECULAR FORMULA
    C19H18N6O4S
    CROSS REFERENCES
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    canSAR2168836
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight426.11
    AlogP2.89
    HBond donors0
    HBond acceptors10
    Atoms48
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2168836.