COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK836376
Chemical Name: ethyl{[5-(4-nitrophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc(n1CC=C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 348.38
Empirical Formula: C15H16N4O4S

Physical State: Dry powder
Available Amount: 539 mg

Lipinsky:
logP: 4.285
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 128
Number of rings: 2

     

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