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canSAR463206
FEATURES
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NAMES
    SMILES
    CN(Cc1ccccc1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1/C(S)=N/Cc1c(Cl)cccc1Cl
    InChI
    InChI=1S/C30H32Cl2N4O2S/c1-35(20-22-12-6-3-7-13-22)29(38)26(18-21-10-4-2-5-11-21)34-28(37)27-16-9-17-36(27)30(39)33-19-23-24(31)14-8-15-25(23)32/h2-8,10-15,26-27H,9,16-20H2,1H3,(H,33,39)(H,34,37)/t26-,27-/m0/s1
    MOLECULAR FORMULA
    C30H32Cl2N4O2S
    CROSS REFERENCES
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    canSAR463206

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 582.16
    AlogP 5.63
    HBond donors 1
    HBond acceptors 6
    Atoms 71
    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 canSAR463206.