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canSAR343564
FEATURES
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NAMES
    SMILES
    COC(=O)[C@H](COC(=O)C=C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C
    InChI
    InChI=1S/C17H29N3O6S/c1-9(2)6-13(21)26-7-12(17(24)25-5)19-16(23)14(10(3)4)20-15(22)11(18)8-27/h6,10-12,14,27H,7-8,18H2,1-5H3,(H,19,23)(H,20,22)/t11-,12-,14-/m0/s1
    MOLECULAR FORMULA
    C17H29N3O6S
    CROSS REFERENCES
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    canSAR343564

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.18
    AlogP -0.45
    HBond donors 4
    HBond acceptors 9
    Atoms 56
    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 canSAR343564.