canSAR740756
FEATURES
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NAMES
    SMILES
    COc1ccc2cc3[n+](cc2c1NCCCCCCN)CCc1cc2c(cc1-3)OCO2.[Cl-]
    InChI
    InChI=1S/C25H29N3O3.ClH/c1-29-22-7-6-17-12-21-19-14-24-23(30-16-31-24)13-18(19)8-11-28(21)15-20(17)25(22)27-10-5-3-2-4-9-26;/h6-7,12-15H,2-5,8-11,16,26H2,1H3;1H
    MOLECULAR FORMULA
    C25H30ClN3O3
    CROSS REFERENCES
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    canSAR740756
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight455.20
    AlogP1.02
    HBond donors3
    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 canSAR740756.