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canSAR1204834
FEATURES
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NAMES
    SMILES
    CC1=C2C(C[C@@H]1OC(=O)c1ccsc1)[C@](C)(O)CC[C@H]1[C@H](C)C(=O)O[C@H]21
    InChI
    InChI=1S/C20H24O5S/c1-10-13-4-6-20(3,23)14-8-15(24-19(22)12-5-7-26-9-12)11(2)16(14)17(13)25-18(10)21/h5,7,9-10,13-15,17,23H,4,6,8H2,1-3H3/t10-,13-,14?,15-,17-,20+/m0/s1
    MOLECULAR FORMULA
    C20H24O5S
    CROSS REFERENCES
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    canSAR1204834

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 376.13
    AlogP 3.33
    HBond donors 1
    HBond acceptors 5
    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 canSAR1204834.