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canSAR199975
FEATURES
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NAMES
    SMILES
    CCOc1c(C(=O)Nc2nn[nH]n2)oc2c3cc(OC)ccc3n(-c3ccccc3)c12
    InChI
    InChI=1S/C21H18N6O4/c1-3-30-18-16-17(31-19(18)20(28)22-21-23-25-26-24-21)14-11-13(29-2)9-10-15(14)27(16)12-7-5-4-6-8-12/h4-11H,3H2,1-2H3,(H2,22,23,24,25,26,28)
    MOLECULAR FORMULA
    C21H18N6O4
    CROSS REFERENCES
    199975 logo

    canSAR199975

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.14
    AlogP 3.55
    HBond donors 2
    HBond acceptors 10
    Atoms 49
    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 canSAR199975.