canSAR2061830
FEATURES
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NAMES
    SMILES
    O=C(/C=C/N1CCc2c(ccnc2N[C@H]2CC[C@H](O)CC2)C1)c1ccccc1O
    InChI
    InChI=1S/C23H27N3O3/c27-18-7-5-17(6-8-18)25-23-19-10-13-26(15-16(19)9-12-24-23)14-11-22(29)20-3-1-2-4-21(20)28/h1-4,9,11-12,14,17-18,27-28H,5-8,10,13,15H2,(H,24,25)/b14-11+/t17-,18-
    MOLECULAR FORMULA
    C23H27N3O3
    CROSS REFERENCES
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    canSAR2061830
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight393.21
    AlogP3.26
    HBond donors3
    HBond acceptors6
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2061830.