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canSAR202106
FEATURES
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NAMES
    SMILES
    COc1cc(OC)cc(Oc2ncccc2-c2n[nH]c(N(C)c3ccncc3)n2)c1
    InChI
    InChI=1S/C21H20N6O3/c1-27(14-6-9-22-10-7-14)21-24-19(25-26-21)18-5-4-8-23-20(18)30-17-12-15(28-2)11-16(13-17)29-3/h4-13H,1-3H3,(H,24,25,26)
    MOLECULAR FORMULA
    C21H20N6O3
    CROSS REFERENCES
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    canSAR202106

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.16
    AlogP 3.84
    HBond donors 1
    HBond acceptors 9
    Atoms 50
    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 canSAR202106.