COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK789159
Chemical Name: dimethyl2-{6-ethoxy-1-[(4-fluorophenyl)acetyl]-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Smiles: CCOc1ccc2c(c1)/C(=C/1\SC(=C(S1)C(=O)OC)C(=O)OC)/C(=S)C(N2C(=O)Cc1ccc(cc1)F)(C)C

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Molecular Weight: 587.71
Empirical Formula: C28H26FNO6S3

Physical State: Dry powder
Available Amount: 332 mg

Lipinsky:
logP: 6.425
Rotatable bonds: 7
H-donors: 0
H-acceptors: 6
PSA: 164
Number of rings: 4

     

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