1686600 logo
canSAR1686600
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(NN=Cc1ccccc1[N+](=O)[O-])Nc1nnc(S)s1
    InChI
    InChI=1S/C10H8N6O3S2/c17-8(12-9-14-15-10(20)21-9)13-11-5-6-3-1-2-4-7(6)16(18)19/h1-5H,(H,15,20)(H2,12,13,14,17)
    MOLECULAR FORMULA
    C10H8N6O3S2
    CROSS REFERENCES
    1686600 logo

    canSAR1686600

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 324.01
    AlogP 1.89
    HBond donors 2
    HBond acceptors 9
    Atoms 29
    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 canSAR1686600.