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canSAR227743
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NAMES
    SMILES
    C#CCCC(=O)Nc1ccc2ccn(Cc3ccc(C(=O)O)cc3OC)c2c1
    InChI
    InChI=1S/C22H20N2O4/c1-3-4-5-21(25)23-18-9-8-15-10-11-24(19(15)13-18)14-17-7-6-16(22(26)27)12-20(17)28-2/h1,6-13H,4-5,14H2,2H3,(H,23,25)(H,26,27)
    MOLECULAR FORMULA
    C22H20N2O4
    CROSS REFERENCES
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    canSAR227743

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 376.14
    AlogP 3.75
    HBond donors 2
    HBond acceptors 6
    Atoms 48
    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 canSAR227743.