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canSAR847352
FEATURES
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NAMES
    SMILES
    CCC(O)(C(=O)OCC1=CC[N+]2([O-])CC[C@H](O)[C@@H]12)c1ccccc1
    InChI
    InChI=1S/C18H23NO5/c1-2-18(22,14-6-4-3-5-7-14)17(21)24-12-13-8-10-19(23)11-9-15(20)16(13)19/h3-8,15-16,20,22H,2,9-12H2,1H3/t15-,16+,18?,19?/m0/s1
    MOLECULAR FORMULA
    C18H23NO5
    CROSS REFERENCES
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    canSAR847352

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 333.16
    AlogP 1.22
    HBond donors 2
    HBond acceptors 6
    Atoms 47
    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 canSAR847352.