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canSAR387988
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NAMES
    SMILES
    O=C(N[C@H](CS(=O)(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO)c1ccncc1
    InChI
    InChI=1S/C21H19N3O6S/c25-20(15-10-12-22-13-11-15)23-19(21(26)24-27)14-31(28,29)18-8-6-17(7-9-18)30-16-4-2-1-3-5-16/h1-13,19,27H,14H2,(H,23,25)(H,24,26)/t19-/m1/s1
    MOLECULAR FORMULA
    C21H19N3O6S
    CROSS REFERENCES
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    canSAR387988

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.10
    AlogP 1.95
    HBond donors 3
    HBond acceptors 9
    Atoms 50
    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 canSAR387988.