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canSAR643273
FEATURES
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NAMES
    SMILES
    Cl.O=C1CCCN1C1CC(N2CCCC2=O)CC(N2CCCC2=O)CC(N2CCCC2=O)CC(N2CCCC2=O)CC(N2CCCC2=O)CC(N2CCCC2=O)CC(N2CCCC2=O)CC(N2CCCC2=O)C1.[Cl-].[Cl-].[Cl-].[Ru+3]
    InChI
    InChI=1S/C54H81N9O9.4ClH.Ru/c64-46-10-1-19-55(46)37-28-38(56-20-2-11-47(56)65)30-40(58-22-4-13-49(58)67)32-42(60-24-6-15-51(60)69)34-44(62-26-8-17-53(62)71)36-45(63-27-9-18-54(63)72)35-43(61-25-7-16-52(61)70)33-41(59-23-5-14-50(59)68)31-39(29-37)57-21-3-12-48(57)66;;;;;/h37-45H,1-36H2;4*1H;/q;;;;;+3/p-3
    MOLECULAR FORMULA
    C54H82Cl4N9O9Ru
    CROSS REFERENCES
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    canSAR643273

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1242.40
    AlogP -5.14
    HBond donors 0
    HBond acceptors 18
    Atoms 159
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR643273.