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canSAR644738
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NAMES
    SMILES
    C=CCc1cc(-c2cc(CC=C)c(O)c(CNCCCl)c2)cc(CNCCCl)c1O.Cl
    InChI
    InChI=1S/C24H30Cl2N2O2.ClH/c1-3-5-17-11-19(13-21(23(17)29)15-27-9-7-25)20-12-18(6-4-2)24(30)22(14-20)16-28-10-8-26;/h3-4,11-14,27-30H,1-2,5-10,15-16H2;1H
    MOLECULAR FORMULA
    C24H31Cl3N2O2
    CROSS REFERENCES
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    canSAR644738

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 484.15
    AlogP 5.30
    HBond donors 4
    HBond acceptors 4
    Atoms 62
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR644738.