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canSAR652651
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NAMES
    SMILES
    CCC(CC)NC(=O)c1nn(-c2ccccc2Cl)c(-c2ccc(Cl)cc2)c1CC#N
    InChI
    InChI=1S/C23H22Cl2N4O/c1-3-17(4-2)27-23(30)21-18(13-14-26)22(15-9-11-16(24)12-10-15)29(28-21)20-8-6-5-7-19(20)25/h5-12,17H,3-4,13H2,1-2H3,(H,27,30)
    MOLECULAR FORMULA
    C23H22Cl2N4O
    CROSS REFERENCES
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    canSAR652651

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.12
    AlogP 5.83
    HBond donors 1
    HBond acceptors 5
    Atoms 52
    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 canSAR652651.