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canSAR1119254
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NAMES
    SMILES
    COc1cc(-c2ccccc2)ccc1N1CCC2(CCN(Cc3ncccc3C)CC2)C1=O
    InChI
    InChI=1S/C28H31N3O2/c1-21-7-6-15-29-24(21)20-30-16-12-28(13-17-30)14-18-31(27(28)32)25-11-10-23(19-26(25)33-2)22-8-4-3-5-9-22/h3-11,15,19H,12-14,16-18,20H2,1-2H3
    MOLECULAR FORMULA
    C28H31N3O2
    CROSS REFERENCES
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    canSAR1119254

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.24
    AlogP 5.08
    HBond donors 0
    HBond acceptors 5
    Atoms 64
    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 canSAR1119254.