COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112421
Chemical Name: ethyl2-{[N-(4-ethoxyphenyl)-N-(methylsulfonyl)alanyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOc1ccc(cc1)N(S(=O)(=O)C)C(C(=O)Nc1sc2c(c1C(=O)OCC)CCCC2)C

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Molecular Weight: 494.63
Empirical Formula: C23H30N2O6S2

Physical State: Dry powder
Available Amount: 262 mg

Lipinsky:
logP: 4.764
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 138
Number of rings: 3

     

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