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canSAR561011
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NAMES
    SMILES
    CC(Cc1ccc(SC(C)(C)C)cc1)NCC(O)c1cccc(Cl)c1
    InChI
    InChI=1S/C21H28ClNOS/c1-15(23-14-20(24)17-6-5-7-18(22)13-17)12-16-8-10-19(11-9-16)25-21(2,3)4/h5-11,13,15,20,23-24H,12,14H2,1-4H3
    MOLECULAR FORMULA
    C21H28ClNOS
    CROSS REFERENCES
    561011 logo

    canSAR561011

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 377.16
    AlogP 5.48
    HBond donors 2
    HBond acceptors 2
    Atoms 53
    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 canSAR561011.