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canSAR1725692
FEATURES
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NAMES
    SMILES
    CCN1C(NCCCCO)=NC(CCc2ccccc2)C(C(=O)OC)C1C
    InChI
    InChI=1S/C21H33N3O3/c1-4-24-16(2)19(20(26)27-3)18(13-12-17-10-6-5-7-11-17)23-21(24)22-14-8-9-15-25/h5-7,10-11,16,18-19,25H,4,8-9,12-15H2,1-3H3,(H,22,23)
    MOLECULAR FORMULA
    C21H33N3O3
    CROSS REFERENCES
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    canSAR1725692

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 375.25
    AlogP 2.22
    HBond donors 2
    HBond acceptors 6
    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 canSAR1725692.