COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL004080
Chemical Name: ethyl5-acetyl-2-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4-methylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccs2)/C#N)sc(c1C)C(=O)C

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Molecular Weight: 443.57
Empirical Formula: C20H17N3O3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.54
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 176
Number of rings: 3

     

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