COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK068409
Chemical Name: 2-(naphthalen-2-yloxy)-1-(4,4,6-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethanone
Smiles: O=C(N1c2c(C)cccc2c2c(C1(C)C)ssc2=S)COc1ccc2c(c1)cccc2

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Molecular Weight: 463.65
Empirical Formula: C25H21NO2S3

Physical State: Dry powder
Available Amount: 450 mg

Lipinsky:
logP: 7.353
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 112
Number of rings: 5

     

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