COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK138190
Chemical Name: dimethyl2-{6-methoxy-1-[(3-methoxyphenyl)carbonyl]-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Smiles: COc1ccc2c(c1)/C(=C\1/SC(=C(S1)C(=O)OC)C(=O)OC)/C(=S)C(N2C(=O)c1cccc(c1)OC)(C)C

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Molecular Weight: 571.7
Empirical Formula: C27H25NO7S3

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.019
Rotatable bonds: 7
H-donors: 0
H-acceptors: 7
PSA: 174
Number of rings: 4

     

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