COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042739
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1cc(cc(c1OC)OC)C1N(c2nc3c(s2)cc(cc3)C)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

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Molecular Weight: 574.61
Empirical Formula: C30H26N2O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.284
Rotatable bonds: 4
H-donors: 1
H-acceptors: 8
PSA: 144
Number of rings: 6

     

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