COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456835
Chemical Name: methyl5-(diethylcarbamoyl)-2-{[(4-ethoxy-2-nitrophenyl)carbamothioyl]amino}-4-methylthiophene-3-carboxylate
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])NC(=S)Nc1sc(c(c1C(=O)OC)C)C(=O)N(CC)CC

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Molecular Weight: 494.59
Empirical Formula: C21H26N4O6S2

Physical State: Dry powder
Available Amount: 880 mg

Lipinsky:
logP: 5.789
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 186
Number of rings: 2

     

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