COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553384
Chemical Name: 3-oxo-2-phenyl-5-[(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)thio]-2,3-dihydropyridazin-4-yl2,3,4,6-tetra-O-acetyl-1-thio-beta-D-glucopyranoside
Smiles: CC(=O)OC[C@H]1O[C@@H](Sc2cnn(c(=O)c2S[C@@H]2O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]2OC(=O)C)OC(=O)C)OC(=O)C)c2ccccc2)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C

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Molecular Weight: 896.9
Empirical Formula: C38H44N2O19S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.159
Rotatable bonds: 11
H-donors: 0
H-acceptors: 19
PSA: 312
Number of rings: 4

     

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