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canSAR1721429
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NAMES
    SMILES
    Cc1ccccc1CN1C(CC(C)C)COc2c(Cl)cccc2S1(=O)=O
    InChI
    InChI=1S/C20H24ClNO3S/c1-14(2)11-17-13-25-20-18(21)9-6-10-19(20)26(23,24)22(17)12-16-8-5-4-7-15(16)3/h4-10,14,17H,11-13H2,1-3H3
    MOLECULAR FORMULA
    C20H24ClNO3S
    CROSS REFERENCES
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    canSAR1721429

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.12
    AlogP 4.65
    HBond donors 0
    HBond acceptors 4
    Atoms 50
    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 canSAR1721429.