COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK147453
Chemical Name: N-(2,5-dimethoxyphenyl)-4-({[4-ethyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Smiles: COc1ccc(cc1NC(=O)c1ccc(cc1)CSc1nnc(n1CC)c1ccc(cc1)[N+](=O)[O-])OC

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Molecular Weight: 519.58
Empirical Formula: C26H25N5O5S

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 5.642
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 149
Number of rings: 4

     

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