COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK341885
Chemical Name: ethyl2-{[4-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)butanoyl]amino}-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccccc1)NC(=O)CCCn1nc(c(c1C)Cl)[N+](=O)[O-]

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Molecular Weight: 476.94
Empirical Formula: C21H21ClN4O5S

Available Amount: 0 mg

Lipinsky:
logP: 5.195
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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