COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK163570
Chemical Name: ethyl2-({[(2-nitrophenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])sc2c1CCCC2

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Molecular Weight: 433.51
Empirical Formula: C19H19N3O5S2

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 5.939
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 173
Number of rings: 3

     

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