canSAR1083973
FEATURES
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NAMES
    SMILES
    COc1ccc(C(CN2CCOCC2)NC(=O)C(C#N)c2nc3ccccc3nc2N2CCCCCC2)cc1
    InChI
    InChI=1S/C30H36N6O3/c1-38-23-12-10-22(11-13-23)27(21-35-16-18-39-19-17-35)34-30(37)24(20-31)28-29(36-14-6-2-3-7-15-36)33-26-9-5-4-8-25(26)32-28/h4-5,8-13,24,27H,2-3,6-7,14-19,21H2,1H3,(H,34,37)
    MOLECULAR FORMULA
    C30H36N6O3
    CROSS REFERENCES
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    canSAR1083973
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight528.28
    AlogP3.82
    HBond donors1
    HBond acceptors9
    Atoms75
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1083973.