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canSAR1154367
FEATURES
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NAMES
    SMILES
    CCCCN(C(=S)Nc1ccccc1Cl)C(CC(=O)OCC)[C@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@H]1OC
    InChI
    InChI=1S/C24H35ClN2O6S/c1-6-8-13-27(23(34)26-16-12-10-9-11-15(16)25)17(14-18(28)30-7-2)19-20(29-5)21-22(31-19)33-24(3,4)32-21/h9-12,17,19-22H,6-8,13-14H2,1-5H3,(H,26,34)/t17?,19-,20+,21-,22-/m1/s1
    MOLECULAR FORMULA
    C24H35ClN2O6S
    CROSS REFERENCES
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    canSAR1154367

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 514.19
    AlogP 4.35
    HBond donors 1
    HBond acceptors 8
    Atoms 69
    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 canSAR1154367.