COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444503
Chemical Name: ethyl5-cyano-4-methyl-2-{[(4-methyl-3,5-dinitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc([N+](=O)[O-])c(c(c2)[N+](=O)[O-])C)sc(c1C)C#N

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Molecular Weight: 418.39
Empirical Formula: C17H14N4O7S

Physical State: Dry powder
Available Amount: 740 mg

Lipinsky:
logP: 5.469
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 199
Number of rings: 2

     

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