COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL011334
Chemical Name: 1-[2-(4-chlorophenoxy)ethyl]-1H-benzimidazol-2-yl3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-1-thio-beta-D-glucopyranoside
Smiles: CC(=O)OC[C@H]1O[C@@H](Sc2nc3c(n2CCOc2ccc(cc2)Cl)cccc3)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)NC(=O)C

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Molecular Weight: 634.11
Empirical Formula: C29H32ClN3O9S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 5.607
Rotatable bonds: 8
H-donors: 1
H-acceptors: 9
PSA: 169
Number of rings: 4

     

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