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canSAR1001084
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NAMES
    SMILES
    COc1c(OCCCN2CCN(C)CC2)cc2oc(-c3ccccc3)cc(=O)c2c1O
    InChI
    InChI=1S/C24H28N2O5/c1-25-10-12-26(13-11-25)9-6-14-30-21-16-20-22(23(28)24(21)29-2)18(27)15-19(31-20)17-7-4-3-5-8-17/h3-5,7-8,15-16,28H,6,9-14H2,1-2H3
    MOLECULAR FORMULA
    C24H28N2O5
    CROSS REFERENCES
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    canSAR1001084

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 424.20
    AlogP 3.19
    HBond donors 1
    HBond acceptors 7
    Atoms 59
    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 canSAR1001084.