COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040714
Chemical Name: (5E)-1-(2,5-dimethoxyphenyl)-5-[(1-ethyl-1H-indol-3-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(cc1N1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)CC)/C1=O)S)OC

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Molecular Weight: 435.5
Empirical Formula: C23H21N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.435
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 4

     

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