canSAR1709497
FEATURES
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NAMES
    SMILES
    CCOc1ccc(-c2c(C(=O)N/N=C/c3cccs3)nnn2-c2nonc2N)cc1
    InChI
    InChI=1S/C18H16N8O3S/c1-2-28-12-7-5-11(6-8-12)15-14(18(27)22-20-10-13-4-3-9-30-13)21-25-26(15)17-16(19)23-29-24-17/h3-10H,2H2,1H3,(H2,19,23)(H,22,27)/b20-10+
    MOLECULAR FORMULA
    C18H16N8O3S
    CROSS REFERENCES
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    canSAR1709497
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight424.11
    AlogP2.12
    HBond donors3
    HBond acceptors11
    Atoms46
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1709497.