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canSAR158955
FEATURES
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NAMES
    SMILES
    COC(=O)[C@H](COC(=O)c1ccc(Cl)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C
    InChI
    InChI=1S/C19H26ClN3O6S/c1-10(2)15(23-16(24)13(21)9-30)17(25)22-14(19(27)28-3)8-29-18(26)11-4-6-12(20)7-5-11/h4-7,10,13-15,30H,8-9,21H2,1-3H3,(H,22,25)(H,23,24)/t13-,14-,15-/m0/s1
    MOLECULAR FORMULA
    C19H26ClN3O6S
    CROSS REFERENCES
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    canSAR158955

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 459.12
    AlogP 0.55
    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 canSAR158955.