COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380856
Chemical Name: ethyl2-({[(5-nitropyridin-2-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2ccc(cn2)[N+](=O)[O-])sc2c1CCCC2

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Molecular Weight: 421.5
Empirical Formula: C18H19N3O5S2

Physical State: Dry powder
Available Amount: 1784 mg

Lipinsky:
logP: 5.137
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 167
Number of rings: 3

     

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