COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380239
Chemical Name: 5-(3-ethoxy-4-hydroxy-5-nitrobenzylidene)-1,3-diethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1cc(C=C2C(=O)N(CC)C(=S)N(C2=O)CC)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 393.42
Empirical Formula: C17H19N3O6S

Physical State: Dry powder
Available Amount: 633 mg

Lipinsky:
logP: 2.79
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 147
Number of rings: 2

     

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