canSAR2096234
FEATURES
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NAMES
    SMILES
    O=C(NCCc1c[nH]cn1)c1ccnc2nc(-c3cccs3)[nH]c12
    InChI
    InChI=1S/C16H14N6OS/c23-16(19-5-3-10-8-17-9-20-10)11-4-6-18-15-13(11)21-14(22-15)12-2-1-7-24-12/h1-2,4,6-9H,3,5H2,(H,17,20)(H,19,23)(H,18,21,22)
    MOLECULAR FORMULA
    C16H14N6OS
    CROSS REFERENCES
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    canSAR2096234
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight338.09
    AlogP2.38
    HBond donors3
    HBond acceptors7
    Atoms38
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096234.