COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280589
Chemical Name: methyl6-{[(1H-1,2,4-triazol-3-ylsulfanyl)acetyl]amino}-1,3-benzodioxole-5-carboxylate
Smiles: COC(=O)c1cc2OCOc2cc1NC(=O)CSc1n[nH]cn1

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Molecular Weight: 336.33
Empirical Formula: C13H12N4O5S

Available Amount: 0 mg

Lipinsky:
logP: 1.63
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 140
Number of rings: 3

     

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