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canSAR399413
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NAMES
    SMILES
    COc1ccc(CC2NCCc3c2[nH]c2ccc(C)cc32)c(N)c1OC
    InChI
    InChI=1S/C21H25N3O2/c1-12-4-6-16-15(10-12)14-8-9-23-17(20(14)24-16)11-13-5-7-18(25-2)21(26-3)19(13)22/h4-7,10,17,23-24H,8-9,11,22H2,1-3H3
    MOLECULAR FORMULA
    C21H25N3O2
    CROSS REFERENCES
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    canSAR399413

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 351.19
    AlogP 3.51
    HBond donors 4
    HBond acceptors 5
    Atoms 51
    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 canSAR399413.