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canSAR467358
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NAMES
    SMILES
    CNCC1(c2ccc(N3CCc4c(C(N)=O)nn(-c5ccc(OC)cc5)c4C3=O)cc2)CC1
    InChI
    InChI=1S/C25H27N5O3/c1-27-15-25(12-13-25)16-3-5-17(6-4-16)29-14-11-20-21(23(26)31)28-30(22(20)24(29)32)18-7-9-19(33-2)10-8-18/h3-10,27H,11-15H2,1-2H3,(H2,26,31)
    MOLECULAR FORMULA
    C25H27N5O3
    CROSS REFERENCES
    467358 logo

    canSAR467358

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 445.21
    AlogP 2.43
    HBond donors 3
    HBond acceptors 8
    Atoms 60
    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 canSAR467358.