canSAR1603966
FEATURES
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NAMES
    SMILES
    N.N=C(CCCCCCCC(=N)NCC#Cc1ccccc1)NCC#Cc1ccccc1
    InChI
    InChI=1S/C27H32N4.H3N/c28-26(30-22-12-18-24-14-6-4-7-15-24)20-10-2-1-3-11-21-27(29)31-23-13-19-25-16-8-5-9-17-25;/h4-9,14-17H,1-3,10-11,20-23H2,(H2,28,30)(H2,29,31);1H3
    MOLECULAR FORMULA
    C27H35N5
    CROSS REFERENCES
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    canSAR1603966
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight429.29
    AlogP5.12
    HBond donors7
    HBond acceptors5
    Atoms67
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1603966.