COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056438
Chemical Name: (4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Smiles: CCOc1cc(ccc1O)C1/C(=C(/c2cccc(c2)OC)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C

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Molecular Weight: 530.6
Empirical Formula: C29H26N2O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.024
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 137
Number of rings: 5

     

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