canSAR418130
FEATURES
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NAMES
    SMILES
    N#Cc1ccc(N2CCN([C@@H]3CN[C@H](C(=O)N4CCSC4)C3)CC2)cc1C#N
    InChI
    InChI=1S/C20H24N6OS/c21-11-15-1-2-17(9-16(15)12-22)24-3-5-25(6-4-24)18-10-19(23-13-18)20(27)26-7-8-28-14-26/h1-2,9,18-19,23H,3-8,10,13-14H2/t18-,19-/m0/s1
    MOLECULAR FORMULA
    C20H24N6OS
    CROSS REFERENCES
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    canSAR418130
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight396.17
    AlogP0.82
    HBond donors1
    HBond acceptors7
    Atoms52
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR418130.