COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK905510
Chemical Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-[3-ethoxy-4-(3-methylbutoxy)phenyl]-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCOc1cc(ccc1OCCC(C)C)C1N(c2nc3c(s2)cc(cc3)OCC)C(=O)C(=C1C(=O)c1ccc2c(c1)CC(O2)C)O

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Molecular Weight: 642.77
Empirical Formula: C36H38N2O7S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 8.457
Rotatable bonds: 12
H-donors: 1
H-acceptors: 7
PSA: 135
Number of rings: 6

     

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