COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079392
Chemical Name: 1-(4,4,7-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one
Smiles: CCC(=O)N1c2cc(C)ccc2c2c(C1(C)C)ssc2=S

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Molecular Weight: 335.52
Empirical Formula: C16H17NOS3

Physical State: Dry powder
Available Amount: 697 mg

Lipinsky:
logP: 5.45
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 103
Number of rings: 3

     

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