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canSAR1014839
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NAMES
    SMILES
    Cc1ccc2sc(/C=C/c3ccc(N(C)C)cc3)[n+](C)c2c1
    InChI
    InChI=1S/C19H21N2S/c1-14-5-11-18-17(13-14)21(4)19(22-18)12-8-15-6-9-16(10-7-15)20(2)3/h5-13H,1-4H3/q+1
    MOLECULAR FORMULA
    C19H21N2S+
    CROSS REFERENCES
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    canSAR1014839

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 309.14
    AlogP 4.27
    HBond donors 0
    HBond acceptors 2
    Atoms 43
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1014839.