COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054782
Chemical Name: (4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1ccc(cc1)/C(=C\1/C(c2cc(OC)c(c(c2)OC)OC)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O

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Molecular Weight: 560.63
Empirical Formula: C30H28N2O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.005
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 135
Number of rings: 5

     

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