COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK789948
Chemical Name: dimethyl2-[6-ethoxy-2,2-dimethyl-1-(phenylcarbamoyl)-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)Nc1ccccc1)(C)C

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Molecular Weight: 570.71
Empirical Formula: C27H26N2O6S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.449
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 176
Number of rings: 4

     

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