COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK031959
Chemical Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-1-(4,4,8-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)ethanone
Smiles: CCOc1ccc2c(c1)sc(n2)SCC(=O)N1c2ccc(cc2c2c(C1(C)C)ssc2=S)C

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Molecular Weight: 530.78
Empirical Formula: C24H22N2O2S5

Physical State: Dry powder
Available Amount: 460 mg

Lipinsky:
logP: 8.427
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 178
Number of rings: 5

     

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