COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK870926
Chemical Name: ethyl(2Z)-2-(8-ethoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate
Smiles: CCOC(=O)C1=C(S/C(=C/2\c3cccc(c3NC(C2=S)(C)C)OCC)/S1)c1ccccc1

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Molecular Weight: 483.68
Empirical Formula: C25H25NO3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.427
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 130
Number of rings: 4

     

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