COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041181
Chemical Name: methyl2-[(3E)-3-[(4-butoxy-3-methylphenyl)(hydroxy)methylidene]-2-(4-chlorophenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)c1nc(c(s1)C(=O)OC)C)/O

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Molecular Weight: 555.05
Empirical Formula: C28H27ClN2O6S

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 7.01
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 134
Number of rings: 4

     

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