COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK514581
Chemical Name: prop-2-en-1-yl2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-2-(3-ethoxy-4-propoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCCOc1ccc(cc1OCC)C1N(c2nc(c(s2)C(=O)OCC=C)C)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 620.68
Empirical Formula: C32H32N2O9S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 6.248
Rotatable bonds: 13
H-donors: 1
H-acceptors: 9
PSA: 161
Number of rings: 5

     

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