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canSAR82885
FEATURES
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NAMES
    SMILES
    COc1ccccc1C(=O)N1CCC(CCN2CCC(C(N)=O)(c3ccccc3)CC2)(c2ccc(Cl)c(Cl)c2)C1
    InChI
    InChI=1S/C32H35Cl2N3O3/c1-40-28-10-6-5-9-25(28)29(38)37-20-14-31(22-37,24-11-12-26(33)27(34)21-24)13-17-36-18-15-32(16-19-36,30(35)39)23-7-3-2-4-8-23/h2-12,21H,13-20,22H2,1H3,(H2,35,39)
    MOLECULAR FORMULA
    C32H35Cl2N3O3
    CROSS REFERENCES
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    canSAR82885

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 579.21
    AlogP 5.70
    HBond donors 2
    HBond acceptors 6
    Atoms 75
    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 canSAR82885.