COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL186036
Chemical Name: 2-{[4-(4-bromobenzyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxy-2-nitrophenyl)acetamide
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])NC(=O)CSc1nnc(n1Cc1ccc(cc1)Br)COc1ccccc1

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Molecular Weight: 598.48
Empirical Formula: C26H24BrN5O5S

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 6.645
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 149
Number of rings: 4

     

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