COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK044352
Chemical Name: ethyl2-({[(4-tert-butylphenyl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)sc2c1CCCC2

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Molecular Weight: 444.62
Empirical Formula: C23H28N2O3S2

Physical State: Dry powder
Available Amount: 471 mg

Lipinsky:
logP: 8.131
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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