canSAR2080449
FEATURES
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NAMES
    SMILES
    CCc1nn2cc(-c3cc4cccc(OCCCC#N)c4o3)nc2s1
    InChI
    InChI=1S/C18H16N4O2S/c1-2-16-21-22-11-13(20-18(22)25-16)15-10-12-6-5-7-14(17(12)24-15)23-9-4-3-8-19/h5-7,10-11H,2-4,9H2,1H3
    MOLECULAR FORMULA
    C18H16N4O2S
    CROSS REFERENCES
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    canSAR2080449
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight352.10
    AlogP4.45
    HBond donors0
    HBond acceptors6
    Atoms41
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080449.