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canSAR1617894
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NAMES
    SMILES
    Nc1nc(CSc2nc3ccccc3s2)nc(N2CCOCC2)n1
    InChI
    InChI=1S/C15H16N6OS2/c16-13-18-12(19-14(20-13)21-5-7-22-8-6-21)9-23-15-17-10-3-1-2-4-11(10)24-15/h1-4H,5-9H2,(H2,16,18,19,20)
    MOLECULAR FORMULA
    C15H16N6OS2
    CROSS REFERENCES
    1617894 logo

    canSAR1617894

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.08
    AlogP 2.19
    HBond donors 2
    HBond acceptors 7
    Atoms 40
    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 canSAR1617894.