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canSAR1268972
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NAMES
    SMILES
    Cc1nc(C)c(CC(=O)Nc2nnc(C(C)C)s2)c(=O)[nH]1
    InChI
    InChI=1S/C13H17N5O2S/c1-6(2)12-17-18-13(21-12)16-10(19)5-9-7(3)14-8(4)15-11(9)20/h6H,5H2,1-4H3,(H,14,15,20)(H,16,18,19)
    MOLECULAR FORMULA
    C13H17N5O2S
    CROSS REFERENCES
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    canSAR1268972

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 307.11
    AlogP 1.54
    HBond donors 2
    HBond acceptors 7
    Atoms 38
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1268972.