COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807587
Chemical Name: ethyl2-({[3-(azepan-1-ylsulfonyl)-4-methylphenyl]carbonyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(c(c2)S(=O)(=O)N2CCCCCC2)C)sc(c1C)C

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Molecular Weight: 478.63
Empirical Formula: C23H30N2O5S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.041
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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