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canSAR847336
FEATURES
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NAMES
    SMILES
    COc1cc2c(cc1OC)C(=O)N1C=C(c3cccc(C#N)c3)C[C@H]1C=N2
    InChI
    InChI=1S/C21H17N3O3/c1-26-19-8-17-18(9-20(19)27-2)23-11-16-7-15(12-24(16)21(17)25)14-5-3-4-13(6-14)10-22/h3-6,8-9,11-12,16H,7H2,1-2H3/t16-/m0/s1
    MOLECULAR FORMULA
    C21H17N3O3
    CROSS REFERENCES
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    canSAR847336

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 359.13
    AlogP 3.55
    HBond donors 0
    HBond acceptors 6
    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 canSAR847336.