canSAR2080247
FEATURES
Loading...
NAMES
    SMILES
    O=[N+]([O-])CCCCCCN1c2ccccc2Sc2cccnc21
    InChI
    InChI=1S/C17H19N3O2S/c21-20(22)13-6-2-1-5-12-19-14-8-3-4-9-15(14)23-16-10-7-11-18-17(16)19/h3-4,7-11H,1-2,5-6,12-13H2
    MOLECULAR FORMULA
    C17H19N3O2S
    CROSS REFERENCES
    Loading...
    canSAR2080247
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight329.12
    AlogP4.52
    HBond donors0
    HBond acceptors5
    Atoms42
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080247.