COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK041223
Chemical Name: ethyl(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(oxo)acetate
Smiles: CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)C(=O)OCC)(C)C

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Molecular Weight: 409.55
Empirical Formula: C18H19NO4S3

Physical State: Dry powder
Available Amount: 497 mg

Lipinsky:
logP: 4.798
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 138
Number of rings: 3

     

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