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canSAR649813
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NAMES
    SMILES
    O=C(Nc1ccncc1)C(=O)c1cn(-c2cc3c(cc2Cl)OCO3)c2ccccc12
    InChI
    InChI=1S/C22H14ClN3O4/c23-16-9-19-20(30-12-29-19)10-18(16)26-11-15(14-3-1-2-4-17(14)26)21(27)22(28)25-13-5-7-24-8-6-13/h1-11H,12H2,(H,24,25,28)
    MOLECULAR FORMULA
    C22H14ClN3O4
    CROSS REFERENCES
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    canSAR649813

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.07
    AlogP 4.23
    HBond donors 1
    HBond acceptors 7
    Atoms 44
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR649813.