COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553713
Chemical Name: 5-phenyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-1-thiohexopyranoside
Smiles: C=CCn1c(nnc1c1ccccc1)SC1OC(COC(=O)C)C(C(C1NC(=O)C)OC(=O)C)OC(=O)C

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Molecular Weight: 546.6
Empirical Formula: C25H30N4O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.969
Rotatable bonds: 12
H-donors: 1
H-acceptors: 8
PSA: 173
Number of rings: 3

     

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