COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553726
Chemical Name: 4-pentyl-5-phenyl-4H-1,2,4-triazol-3-yl3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-1-thiohexopyranoside
Smiles: CCCCCn1c(nnc1c1ccccc1)SC1OC(COC(=O)C)C(C(C1NC(=O)C)OC(=O)C)OC(=O)C

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Molecular Weight: 576.67
Empirical Formula: C27H36N4O8S

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 5.267
Rotatable bonds: 14
H-donors: 1
H-acceptors: 8
PSA: 173
Number of rings: 3

     

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