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canSAR1635125
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NAMES
    SMILES
    Cl.Cl.Cl.Cl.Cl.Cl.Nc1ccccc1CNCCCCCCNCCSSCCNCCCCCCNCc1ccccc1N
    InChI
    InChI=1S/C30H52N6S2.6ClH/c31-29-15-7-5-13-27(29)25-35-19-11-3-1-9-17-33-21-23-37-38-24-22-34-18-10-2-4-12-20-36-26-28-14-6-8-16-30(28)32;;;;;;/h5-8,13-16,33-36H,1-4,9-12,17-26,31-32H2;6*1H
    MOLECULAR FORMULA
    C30H58Cl6N6S2
    CROSS REFERENCES
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    canSAR1635125

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 776.23
    AlogP 7.94
    HBond donors 8
    HBond acceptors 6
    Atoms 102
    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 canSAR1635125.