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canSAR780349
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NAMES
    SMILES
    CCOc1ccccc1N1CCN(Cn2nc(Cc3ccc(SC)cc3)oc2=S)CC1
    InChI
    InChI=1S/C23H28N4O2S2/c1-3-28-21-7-5-4-6-20(21)26-14-12-25(13-15-26)17-27-23(30)29-22(24-27)16-18-8-10-19(31-2)11-9-18/h4-11H,3,12-17H2,1-2H3
    MOLECULAR FORMULA
    C23H28N4O2S2
    CROSS REFERENCES
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    canSAR780349

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 456.17
    AlogP 4.70
    HBond donors 0
    HBond acceptors 6
    Atoms 59
    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 canSAR780349.