COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK340947
Chemical Name: ethyl2-{[4-(3-nitro-1H-1,2,4-triazol-1-yl)butanoyl]amino}-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccccc1)NC(=O)CCCn1cnc(n1)[N+](=O)[O-]

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Molecular Weight: 429.46
Empirical Formula: C19H19N5O5S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 3.208
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 160
Number of rings: 3

     

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