canSAR1603391
FEATURES
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NAMES
    SMILES
    C=CCn1c(SCC(N)=O)nnc1-c1ccccc1O
    InChI
    InChI=1S/C13H14N4O2S/c1-2-7-17-12(9-5-3-4-6-10(9)18)15-16-13(17)20-8-11(14)19/h2-6,18H,1,7-8H2,(H2,14,19)
    MOLECULAR FORMULA
    C13H14N4O2S
    CROSS REFERENCES
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    canSAR1603391
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight290.08
    AlogP1.41
    HBond donors3
    HBond acceptors6
    Atoms34
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1603391.