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canSAR668564
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NAMES
    SMILES
    CCCc1nc(C)c2c(N(S(C)(=O)=O)S(C)(=O)=O)nc3ccc(OC)nc3n12
    InChI
    InChI=1S/C16H21N5O5S2/c1-6-7-12-17-10(2)14-16(21(27(4,22)23)28(5,24)25)18-11-8-9-13(26-3)19-15(11)20(12)14/h8-9H,6-7H2,1-5H3
    MOLECULAR FORMULA
    C16H21N5O5S2
    CROSS REFERENCES
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    canSAR668564

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.10
    AlogP 1.27
    HBond donors 0
    HBond acceptors 10
    Atoms 49
    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 canSAR668564.