COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417593
Chemical Name: 2-{(E)-2-[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethenyl}-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: [O-][N+](=O)c1c(O)nc([nH]c1=O)/C=C/c1cc(n(c1C)c1ccc(c(c1)C)C)C

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Molecular Weight: 380.4
Empirical Formula: C20H20N4O4

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 3.191
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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