COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK081836
Chemical Name: 1-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)ethanone
Smiles: CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)CSc1nnc[nH]1)(C)C

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Molecular Weight: 450.63
Empirical Formula: C18H18N4O2S4

Physical State: Dry powder
Available Amount: 451 mg

Lipinsky:
logP: 4.486
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 179
Number of rings: 4

     

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