COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK870511
Chemical Name: ethyl4,5-dimethyl-2-({[(4-nitrophenyl)carbonyl]carbamothioyl}amino)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(cc2)[N+](=O)[O-])sc(c1C)C

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Molecular Weight: 407.47
Empirical Formula: C17H17N3O5S2

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 5.638
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 173
Number of rings: 2

     

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