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canSAR1270784
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NAMES
    SMILES
    Cc1ccsc1C(=CCCNCCC(=O)O)c1sccc1C
    InChI
    InChI=1S/C17H21NO2S2/c1-12-6-10-21-16(12)14(17-13(2)7-11-22-17)4-3-8-18-9-5-15(19)20/h4,6-7,10-11,18H,3,5,8-9H2,1-2H3,(H,19,20)
    MOLECULAR FORMULA
    C17H21NO2S2
    CROSS REFERENCES
    1270784 logo

    canSAR1270784

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 335.10
    AlogP 4.31
    HBond donors 2
    HBond acceptors 3
    Atoms 43
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1270784.