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canSAR1446211
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NAMES
    SMILES
    C=C(C)Cn1c2ccc(NC(=O)CCc3cccc(Cl)c3)cc2c(=O)n1C
    InChI
    InChI=1S/C21H22ClN3O2/c1-14(2)13-25-19-9-8-17(12-18(19)21(27)24(25)3)23-20(26)10-7-15-5-4-6-16(22)11-15/h4-6,8-9,11-12H,1,7,10,13H2,2-3H3,(H,23,26)
    MOLECULAR FORMULA
    C21H22ClN3O2
    CROSS REFERENCES
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    canSAR1446211

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.14
    AlogP 4.14
    HBond donors 1
    HBond acceptors 5
    Atoms 49
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1446211.