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canSAR1765856
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NAMES
    SMILES
    CCN(CC)c1ccc(N/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)cc1
    InChI
    InChI=1S/C21H22N4O3/c1-3-24(4-2)16-12-10-15(11-13-16)22-14-18-19(26)23-21(28)25(20(18)27)17-8-6-5-7-9-17/h5-14,22H,3-4H2,1-2H3,(H,23,26,28)/b18-14-
    MOLECULAR FORMULA
    C21H22N4O3
    CROSS REFERENCES
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    canSAR1765856

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 378.17
    AlogP 3.11
    HBond donors 2
    HBond acceptors 7
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1765856.