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canSAR1650664
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NAMES
    SMILES
    Br.CC1CC(=O)NN=C1c1ccc(NC(=O)CCNCC(O)COc2ccccc2)cc1
    InChI
    InChI=1S/C23H28N4O4.BrH/c1-16-13-22(30)26-27-23(16)17-7-9-18(10-8-17)25-21(29)11-12-24-14-19(28)15-31-20-5-3-2-4-6-20;/h2-10,16,19,24,28H,11-15H2,1H3,(H,25,29)(H,26,30);1H
    MOLECULAR FORMULA
    C23H29BrN4O4
    CROSS REFERENCES
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    canSAR1650664

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 504.14
    AlogP 2.48
    HBond donors 4
    HBond acceptors 8
    Atoms 61
    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 canSAR1650664.