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canSAR1689465
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NAMES
    SMILES
    Cc1ccccc1Nc1nc(N)nc(CSc2nc3ccccc3s2)n1
    InChI
    InChI=1S/C18H16N6S2/c1-11-6-2-3-7-12(11)20-17-23-15(22-16(19)24-17)10-25-18-21-13-8-4-5-9-14(13)26-18/h2-9H,10H2,1H3,(H3,19,20,22,23,24)
    MOLECULAR FORMULA
    C18H16N6S2
    CROSS REFERENCES
    1689465 logo

    canSAR1689465

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.09
    AlogP 4.41
    HBond donors 3
    HBond acceptors 6
    Atoms 42
    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 canSAR1689465.