COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK077172
Chemical Name: dimethyl2-(7-methoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
Smiles: COc1ccc2c(c1)NC(C(=S)/C/2=C/1\SC(=C(S1)C(=O)OC)C(=O)OC)(C)C

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Molecular Weight: 437.56
Empirical Formula: C19H19NO5S3

Physical State: Dry powder
Available Amount: 450 mg

Lipinsky:
logP: 3.528
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 156
Number of rings: 3

     

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