COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK871313
Chemical Name: ethyl(2Z)-2-(2,2,7-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4-carboxylate
Smiles: CCOC(=O)C1=CS/C(=C/2\c3ccc(cc3NC(C2=S)(C)C)C)/S1

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Molecular Weight: 377.55
Empirical Formula: C18H19NO2S3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 4.88
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 121
Number of rings: 3

     

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