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canSAR351645
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NAMES
    SMILES
    O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccccc3OCCCO)cc1)C2
    InChI
    InChI=1S/C22H23N3O6/c26-10-3-11-29-20-5-2-1-4-19(20)17-8-6-16(7-9-17)14-30-18-12-24-13-21(25(27)28)23-22(24)31-15-18/h1-2,4-9,13,18,26H,3,10-12,14-15H2/t18-/m0/s1
    MOLECULAR FORMULA
    C22H23N3O6
    CROSS REFERENCES
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    canSAR351645

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.16
    AlogP 3.20
    HBond donors 1
    HBond acceptors 9
    Atoms 54
    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 canSAR351645.