COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK342092
Chemical Name: ethyl4,5-dimethyl-2-{[4-(3-nitro-1H-1,2,4-triazol-1-yl)butanoyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCCn2cnc(n2)[N+](=O)[O-])sc(c1C)C

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Molecular Weight: 381.41
Empirical Formula: C15H19N5O5S

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: 2.671
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 160
Number of rings: 2

     

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