COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK601233
Chemical Name: (5E)-3-(2,5-dimethoxyphenyl)-5-[4-(dimethylamino)-3-nitrobenzylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1N1C(=O)N=C(/C(=C\c2ccc(c(c2)[N+](=O)[O-])N(C)C)/C1=O)O)OC

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Molecular Weight: 440.41
Empirical Formula: C21H20N4O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.006
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 137
Number of rings: 3

     

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