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canSAR1130812
FEATURES
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NAMES
    SMILES
    O=C1C(=O)c2c(nc3ncnn3c2-c2cccc([N+](=O)[O-])c2)-c2ccccc21
    InChI
    InChI=1S/C19H9N5O4/c25-17-13-7-2-1-6-12(13)15-14(18(17)26)16(23-19(22-15)20-9-21-23)10-4-3-5-11(8-10)24(27)28/h1-9H
    MOLECULAR FORMULA
    C19H9N5O4
    CROSS REFERENCES
    1130812 logo

    canSAR1130812

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 371.07
    AlogP 2.75
    HBond donors 0
    HBond acceptors 9
    Atoms 37
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1130812.