COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK788966
Chemical Name: 2-(2-chlorophenoxy)-1-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethanone
Smiles: CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)COc1ccccc1Cl)(C)C

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Molecular Weight: 478.06
Empirical Formula: C22H20ClNO3S3

Physical State: Dry powder
Available Amount: 751 mg

Lipinsky:
logP: 6.614
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 121
Number of rings: 4

     

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