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canSAR1121948
FEATURES
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NAMES
    SMILES
    O=C(CN1CCN(c2nccs2)CC1)Nc1nc2c(s1)CCCC2
    InChI
    InChI=1S/C16H21N5OS2/c22-14(19-15-18-12-3-1-2-4-13(12)24-15)11-20-6-8-21(9-7-20)16-17-5-10-23-16/h5,10H,1-4,6-9,11H2,(H,18,19,22)
    MOLECULAR FORMULA
    C16H21N5OS2
    CROSS REFERENCES
    1121948 logo

    canSAR1121948

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.12
    AlogP 2.24
    HBond donors 1
    HBond acceptors 6
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1121948.