COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK803942
Chemical Name: 4-ethyl2-prop-2-en-1-yl5-{[(Z)-2-cyano-2-{4-[4-(2-methylpropyl)phenyl]-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)c1ccc(cc1)CC(C)C)/C#N

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Molecular Weight: 535.69
Empirical Formula: C28H29N3O4S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 9.979
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 157
Number of rings: 3

     

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