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canSAR551183
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NAMES
    SMILES
    CO/N=C(\C)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1.O=C(O)C(=O)O
    InChI
    InChI=1S/C22H28N2O2.C2H2O4/c1-18(23-25-2)21-10-12-22(13-11-21)26-17-20-8-6-19(7-9-20)16-24-14-4-3-5-15-24;3-1(4)2(5)6/h6-13H,3-5,14-17H2,1-2H3;(H,3,4)(H,5,6)/b23-18+;
    MOLECULAR FORMULA
    C24H30N2O6
    CROSS REFERENCES
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    canSAR551183

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.21
    AlogP 3.78
    HBond donors 2
    HBond acceptors 8
    Atoms 62
    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 canSAR551183.