COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK119534
Chemical Name: methyl2-{[N-(3,4-dimethoxyphenyl)-N-(methylsulfonyl)glycyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COc1cc(ccc1OC)N(S(=O)(=O)C)CC(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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Molecular Weight: 482.58
Empirical Formula: C21H26N2O7S2

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 3.331
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 147
Number of rings: 3

     

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