COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK818043
Chemical Name: ethyl2-[3-(1-benzofuran-2-ylcarbonyl)-4-hydroxy-5-oxo-2-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1C(c2cc(OC)c(c(c2)OC)OC)C(=C(C1=O)O)C(=O)c1cc2c(o1)cccc2

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Saltdata: 1/5CH3COOH
Molecular Weight: 578.6
Empirical Formula: C29H26N2O9S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 3.975
Rotatable bonds: 8
H-donors: 1
H-acceptors: 9
PSA: 165
Number of rings: 5

     

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