canSAR1387622
FEATURES
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NAMES
    SMILES
    COc1cccc(OC)c1OCCNCC(O)COc1ccccc1.O=C(O)C(=O)O
    InChI
    InChI=1S/C19H25NO5.C2H2O4/c1-22-17-9-6-10-18(23-2)19(17)24-12-11-20-13-15(21)14-25-16-7-4-3-5-8-16;3-1(4)2(5)6/h3-10,15,20-21H,11-14H2,1-2H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C21H27NO9
    CROSS REFERENCES
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    canSAR1387622
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight437.17
    AlogP1.27
    HBond donors4
    HBond acceptors10
    Atoms58
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387622.