COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526595
Chemical Name: (2R,3S,4R,5R,6R)-5-acetamido-2-(acetoxymethyl)-6-((R)-2-((3aR,5R,6S,6aR)-2,2-dimethyl-6-(pentyloxy)tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)-2-hydroxyethoxy)tetrahydro-2H-pyran-3,4-diyldiacetate
Smiles: CCCCCO[C@H]1[C@H](O[C@H]2[C@@H]1OC(O2)(C)C)C(CO[C@@H]1O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]1NC(=O)C)OC(=O)C)OC(=O)C)O

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Molecular Weight: 619.66
Empirical Formula: C28H45NO14

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.725
Rotatable bonds: 11
H-donors: 2
H-acceptors: 14
PSA: 183
Number of rings: 3

     

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