canSAR2059917
FEATURES
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NAMES
    SMILES
    CCc1cc2c(cc1N1CCN(C(=O)C3COCCN3)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O
    InChI
    InChI=1S/C30H33N5O3/c1-4-19-14-21-22(15-25(19)34-8-10-35(11-9-34)29(37)24-17-38-12-7-32-24)30(2,3)28-26(27(21)36)20-6-5-18(16-31)13-23(20)33-28/h5-6,13-15,24,32-33H,4,7-12,17H2,1-3H3
    MOLECULAR FORMULA
    C30H33N5O3
    CROSS REFERENCES
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    canSAR2059917
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight511.26
    AlogP3.11
    HBond donors2
    HBond acceptors8
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2059917.