848481 logo
canSAR848481
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@@]1(CCl)S[C@@H]2[C@@H](Br)C(=O)N2[C@H]1C(=O)O
    InChI
    InChI=1S/C8H9BrClNO3S/c1-8(2-10)4(7(13)14)11-5(12)3(9)6(11)15-8/h3-4,6H,2H2,1H3,(H,13,14)/t3-,4-,6+,8-/m0/s1
    MOLECULAR FORMULA
    C8H9BrClNO3S
    CROSS REFERENCES
    848481 logo

    canSAR848481

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 312.92
    AlogP 1.12
    HBond donors 1
    HBond acceptors 4
    Atoms 24
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR848481.