COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL341773
Chemical Name: 4-ethyl2-prop-2-en-1-yl5-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: C=CCOC(=O)c1sc(c(c1C)C(=O)OCC)N/C=C(\c1scc(n1)c1cccs1)/C#N

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Molecular Weight: 485.61
Empirical Formula: C22H19N3O4S3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 7.914
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 186
Number of rings: 3

     

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