COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK803935
Chemical Name: 2-tert-butyl4-ethyl5-({(Z)-2-cyano-2-[4-(thiophen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(N/C=C(\c2scc(n2)c2cccs2)/C#N)sc(c1C)C(=O)OC(C)(C)C

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Molecular Weight: 501.65
Empirical Formula: C23H23N3O4S3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 8.314
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 186
Number of rings: 3

     

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