canSAR1631805
FEATURES
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NAMES
    SMILES
    Cc1c(CCO)sc[n+]1CC(=O)OC12CC3CC(CC(C3)C1)C2.[Cl-]
    InChI
    InChI=1S/C18H26NO3S.ClH/c1-12-16(2-3-20)23-11-19(12)10-17(21)22-18-7-13-4-14(8-18)6-15(5-13)9-18;/h11,13-15,20H,2-10H2,1H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C18H26ClNO3S
    CROSS REFERENCES
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    canSAR1631805
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight371.13
    AlogP-0.61
    HBond donors1
    HBond acceptors4
    Atoms50
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1631805.