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canSAR1828757
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NAMES
    SMILES
    C=CCn1c(CCc2ccccc2)nc2cc(/C=C/C(=O)NO)ccc21
    InChI
    InChI=1S/C21H21N3O2/c1-2-14-24-19-11-8-17(10-13-21(25)23-26)15-18(19)22-20(24)12-9-16-6-4-3-5-7-16/h2-8,10-11,13,15,26H,1,9,12,14H2,(H,23,25)/b13-10+
    MOLECULAR FORMULA
    C21H21N3O2
    CROSS REFERENCES
    1828757 logo

    canSAR1828757

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 347.16
    AlogP 3.53
    HBond donors 2
    HBond acceptors 5
    Atoms 47
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1828757.