109070 logo
canSAR109070
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=[N+]([O-])c1ccc(/C=N/N=C(\S)N2CCCCCC2)s1
    InChI
    InChI=1S/C12H16N4O2S2/c17-16(18)11-6-5-10(20-11)9-13-14-12(19)15-7-3-1-2-4-8-15/h5-6,9H,1-4,7-8H2,(H,14,19)/b13-9+
    MOLECULAR FORMULA
    C12H16N4O2S2
    CROSS REFERENCES
    109070 logo

    canSAR109070

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 312.07
    AlogP 3.15
    HBond donors 0
    HBond acceptors 6
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR109070.