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canSAR1444881
FEATURES
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NAMES
    SMILES
    C=CCn1c(O)nnc1Sc1ncc([N+](=O)[O-])s1
    InChI
    InChI=1S/C8H7N5O3S2/c1-2-3-12-6(14)10-11-7(12)18-8-9-4-5(17-8)13(15)16/h2,4H,1,3H2,(H,10,14)
    MOLECULAR FORMULA
    C8H7N5O3S2
    CROSS REFERENCES
    1444881 logo

    canSAR1444881

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 285.00
    AlogP 1.69
    HBond donors 1
    HBond acceptors 8
    Atoms 25
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1444881.