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canSAR1686261
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NAMES
    SMILES
    O=S(=O)(c1ccc2oc(SCc3cn4ccsc4n3)nc2c1)N1CCOCC1
    InChI
    InChI=1S/C17H16N4O4S3/c22-28(23,21-3-6-24-7-4-21)13-1-2-15-14(9-13)19-17(25-15)27-11-12-10-20-5-8-26-16(20)18-12/h1-2,5,8-10H,3-4,6-7,11H2
    MOLECULAR FORMULA
    C17H16N4O4S3
    CROSS REFERENCES
    1686261 logo

    canSAR1686261

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.03
    AlogP 2.85
    HBond donors 0
    HBond acceptors 8
    Atoms 44
    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 canSAR1686261.