COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049382
Chemical Name: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-propoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Smiles: CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C

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Molecular Weight: 598.72
Empirical Formula: C34H34N2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.324
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 126
Number of rings: 6

     

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