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canSAR1020437
FEATURES
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NAMES
    SMILES
    C[C@H](SC(CC(=O)c1ccc(Cl)cc1)C(=O)O)c1ccccc1
    InChI
    InChI=1S/C18H17ClO3S/c1-12(13-5-3-2-4-6-13)23-17(18(21)22)11-16(20)14-7-9-15(19)10-8-14/h2-10,12,17H,11H2,1H3,(H,21,22)/t12-,17?/m0/s1
    MOLECULAR FORMULA
    C18H17ClO3S
    CROSS REFERENCES
    1020437 logo

    canSAR1020437

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.06
    AlogP 4.86
    HBond donors 1
    HBond acceptors 3
    Atoms 40
    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 canSAR1020437.