canSAR1529850
FEATURES
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NAMES
    SMILES
    CCn1c(SCC(=O)c2ccc3ccccc3c2)nnc1-c1ccco1
    InChI
    InChI=1S/C20H17N3O2S/c1-2-23-19(18-8-5-11-25-18)21-22-20(23)26-13-17(24)16-10-9-14-6-3-4-7-15(14)12-16/h3-12H,2,13H2,1H3
    MOLECULAR FORMULA
    C20H17N3O2S
    CROSS REFERENCES
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    canSAR1529850
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight363.10
    AlogP4.69
    HBond donors0
    HBond acceptors5
    Atoms43
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1529850.