canSAR1746854
FEATURES
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NAMES
    SMILES
    COc1cccc(/C=C/C(=N/NC(N)=S)c2ccccc2)c1
    InChI
    InChI=1S/C17H17N3OS/c1-21-15-9-5-6-13(12-15)10-11-16(19-20-17(18)22)14-7-3-2-4-8-14/h2-12H,1H3,(H3,18,20,22)/b11-10+,19-16-
    MOLECULAR FORMULA
    C17H17N3OS
    CROSS REFERENCES
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    canSAR1746854
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight311.11
    AlogP2.95
    HBond donors3
    HBond acceptors4
    Atoms39
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746854.