canSAR1605170
FEATURES
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NAMES
    SMILES
    COc1cccc(CN2CC(=O)C(c3nc(-c4ccc(Cl)cc4)cs3)=C2N)c1
    InChI
    InChI=1S/C21H18ClN3O2S/c1-27-16-4-2-3-13(9-16)10-25-11-18(26)19(20(25)23)21-24-17(12-28-21)14-5-7-15(22)8-6-14/h2-9,12H,10-11,23H2,1H3
    MOLECULAR FORMULA
    C21H18ClN3O2S
    CROSS REFERENCES
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    canSAR1605170
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight411.08
    AlogP4.18
    HBond donors2
    HBond acceptors5
    Atoms46
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1605170.