canSAR741132
FEATURES
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NAMES
    SMILES
    COc1ccc2cc3[n+](cc2c1NCCN1CCCCC1)CCc1cc2c(cc1-3)OCO2
    InChI
    InChI=1S/C26H29N3O3/c1-30-23-6-5-18-13-22-20-15-25-24(31-17-32-25)14-19(20)7-11-29(22)16-21(18)26(23)27-8-12-28-9-3-2-4-10-28/h5-6,13-16H,2-4,7-12,17H2,1H3/p+1
    MOLECULAR FORMULA
    C26H30N3O3+
    CROSS REFERENCES
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    canSAR741132
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight432.23
    AlogP3.99
    HBond donors1
    HBond acceptors6
    Atoms62
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR741132.