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canSAR1149781
FEATURES
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NAMES
    SMILES
    Cc1c(C(=O)OC(C)C)[nH]c2c1C(=O)CC(c1cccs1)C2
    InChI
    InChI=1S/C17H19NO3S/c1-9(2)21-17(20)16-10(3)15-12(18-16)7-11(8-13(15)19)14-5-4-6-22-14/h4-6,9,11,18H,7-8H2,1-3H3
    MOLECULAR FORMULA
    C17H19NO3S
    CROSS REFERENCES
    1149781 logo

    canSAR1149781

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 317.11
    AlogP 3.86
    HBond donors 1
    HBond acceptors 4
    Atoms 41
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1149781.