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canSAR501093
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NAMES
    SMILES
    CC(=O)c1cccc(Nc2sc3c(C)c(O)c4ccccc4c3[n+]2C)c1
    InChI
    InChI=1S/C21H18N2O2S/c1-12-19(25)17-10-5-4-9-16(17)18-20(12)26-21(23(18)3)22-15-8-6-7-14(11-15)13(2)24/h4-11,25H,1-3H3/p+1
    MOLECULAR FORMULA
    C21H19N2O2S+
    CROSS REFERENCES
    501093 logo

    canSAR501093

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.12
    AlogP 4.84
    HBond donors 2
    HBond acceptors 4
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR501093.