COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044960
Chemical Name: (5E)-1-ethyl-5-[(5-nitrothiophen-2-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCN1C(=NC(=O)/C(=C\c2ccc(s2)[N+](=O)[O-])/C1=O)S

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Molecular Weight: 311.34
Empirical Formula: C11H9N3O4S2

Physical State: Dry powder
Available Amount: 254 mg

Lipinsky:
logP: 2.216
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 162
Number of rings: 2

     

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