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canSAR1619466
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NAMES
    SMILES
    Cc1nn(C)c(C)c1N[S+](=O)([O-])c1ccc2c(c1)OCCCO2
    InChI
    InChI=1S/C15H19N3O4S/c1-10-15(11(2)18(3)16-10)17-23(19,20)12-5-6-13-14(9-12)22-8-4-7-21-13/h5-6,9H,4,7-8H2,1-3H3,(H-,17,19,20)
    MOLECULAR FORMULA
    C15H19N3O4S
    CROSS REFERENCES
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    canSAR1619466

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 337.11
    AlogP 2.21
    HBond donors 1
    HBond acceptors 7
    Atoms 42
    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 canSAR1619466.