COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042236
Chemical Name: (4E)-5-(3,4-diethoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1OCC)C1N(c2nc3c(s2)cc(cc3)OCC)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O

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Molecular Weight: 600.69
Empirical Formula: C33H32N2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.319
Rotatable bonds: 9
H-donors: 1
H-acceptors: 7
PSA: 135
Number of rings: 6

     

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