canSAR1417258
FEATURES
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NAMES
    SMILES
    CCC(CC)C(=O)Nc1cccc(-c2nc3cccnc3s2)c1
    InChI
    InChI=1S/C18H19N3OS/c1-3-12(4-2)16(22)20-14-8-5-7-13(11-14)17-21-15-9-6-10-19-18(15)23-17/h5-12H,3-4H2,1-2H3,(H,20,22)
    MOLECULAR FORMULA
    C18H19N3OS
    CROSS REFERENCES
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    canSAR1417258
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight325.12
    AlogP4.73
    HBond donors1
    HBond acceptors4
    Atoms42
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417258.