canSAR1642832
FEATURES
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NAMES
    SMILES
    Clc1ccc2c(c1)C(N1CCNCC1)Cc1ccccc1S2
    InChI
    InChI=1S/C18H19ClN2S/c19-14-5-6-18-15(12-14)16(21-9-7-20-8-10-21)11-13-3-1-2-4-17(13)22-18/h1-6,12,16,20H,7-11H2
    MOLECULAR FORMULA
    C18H19ClN2S
    CROSS REFERENCES
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    canSAR1642832
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight330.10
    AlogP3.99
    HBond donors1
    HBond acceptors2
    Atoms41
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1642832.