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canSAR1767222
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NAMES
    SMILES
    COc1cccc(C=Nn2c(S)nnc2-c2cc(C)[nH]n2)c1
    InChI
    InChI=1S/C14H14N6OS/c1-9-6-12(17-16-9)13-18-19-14(22)20(13)15-8-10-4-3-5-11(7-10)21-2/h3-8H,1-2H3,(H,16,17)(H,19,22)
    MOLECULAR FORMULA
    C14H14N6OS
    CROSS REFERENCES
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    canSAR1767222

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 314.09
    AlogP 2.16
    HBond donors 1
    HBond acceptors 7
    Atoms 36
    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 canSAR1767222.