COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567042
Chemical Name: methyl2-[(3E)-3-{[4-(benzyloxy)-3-methylphenyl](hydroxy)methylidene}-2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOc1cc(ccc1O)C1N(c2nc(c(s2)C(=O)OC)C)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)C)OCc1ccccc1)/O

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Molecular Weight: 614.68
Empirical Formula: C33H30N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.976
Rotatable bonds: 10
H-donors: 2
H-acceptors: 8
PSA: 163
Number of rings: 5

     

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