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canSAR1690206
FEATURES
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NAMES
    SMILES
    O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)Nc1nc2c(s1)CCCC2
    InChI
    InChI=1S/C17H21N3O4S3/c21-15(19-17-18-13-3-1-2-4-14(13)26-17)11-12-5-6-16(25-12)27(22,23)20-7-9-24-10-8-20/h5-6H,1-4,7-11H2,(H,18,19,21)
    MOLECULAR FORMULA
    C17H21N3O4S3
    CROSS REFERENCES
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    canSAR1690206

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.07
    AlogP 2.29
    HBond donors 1
    HBond acceptors 7
    Atoms 48
    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 canSAR1690206.