canSAR382425
FEATURES
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NAMES
    SMILES
    COC1(C#CC(O)(c2ccccc2)c2cncnc2)CN2CCC1CC2
    InChI
    InChI=1S/C21H23N3O2/c1-26-20(15-24-11-7-17(20)8-12-24)9-10-21(25,18-5-3-2-4-6-18)19-13-22-16-23-14-19/h2-6,13-14,16-17,25H,7-8,11-12,15H2,1H3
    MOLECULAR FORMULA
    C21H23N3O2
    CROSS REFERENCES
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    canSAR382425
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight349.18
    AlogP1.83
    HBond donors1
    HBond acceptors5
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR382425.