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canSAR1689250
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NAMES
    SMILES
    COCCn1c(C)cc(C2=NN=C(Nc3ccccc3)SC2)c1C
    InChI
    InChI=1S/C18H22N4OS/c1-13-11-16(14(2)22(13)9-10-23-3)17-12-24-18(21-20-17)19-15-7-5-4-6-8-15/h4-8,11H,9-10,12H2,1-3H3,(H,19,21)
    MOLECULAR FORMULA
    C18H22N4OS
    CROSS REFERENCES
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    canSAR1689250

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.15
    AlogP 3.67
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    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 canSAR1689250.