COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK120044
Chemical Name: methyl4-cyano-3-methyl-5-{[(4-nitrophenoxy)acetyl]amino}thiophene-2-carboxylate
Smiles: COC(=O)c1sc(c(c1C)C#N)NC(=O)COc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 375.36
Empirical Formula: C16H13N3O6S

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 2.875
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 162
Number of rings: 2

     

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