canSAR1932538
FEATURES
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NAMES
    SMILES
    Cc1cc(NC(=S)N(CCCN2CCC[C@@H](C)C2)Cc2cccs2)ccc1Cl
    InChI
    InChI=1S/C22H30ClN3S2/c1-17-6-3-10-25(15-17)11-5-12-26(16-20-7-4-13-28-20)22(27)24-19-8-9-21(23)18(2)14-19/h4,7-9,13-14,17H,3,5-6,10-12,15-16H2,1-2H3,(H,24,27)/t17-/m1/s1
    MOLECULAR FORMULA
    C22H30ClN3S2
    CROSS REFERENCES
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    canSAR1932538
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight435.16
    AlogP6.03
    HBond donors1
    HBond acceptors3
    Atoms58
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932538.