COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK412816
Chemical Name: ethyl4-cyano-3-methyl-5-{[(3-nitrophenyl)carbonyl]amino}thiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)NC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 359.36
Empirical Formula: C16H13N3O5S

Physical State: Dry powder
Available Amount: 529 mg

Lipinsky:
logP: 3.882
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 153
Number of rings: 2

     

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