COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK051908
Chemical Name: 2-[2-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]-1H-isoindole-1,3(2H)-dione
Smiles: CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)CN1C(=O)c2c(C1=O)cccc2)(C)C

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Molecular Weight: 496.63
Empirical Formula: C24H20N2O4S3

Physical State: Dry powder
Available Amount: 472 mg

Lipinsky:
logP: 6.383
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 149
Number of rings: 5

     

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