COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL008454
Chemical Name: ethyl4-{2-[bis(6-hydroxy-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]-4-nitrophenyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ccc(cc1C(c1c(O)n(C)c(=O)n(c1=O)C)c1c(O)n(C)c(=O)n(c1=O)C)[N+](=O)[O-]

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Molecular Weight: 601.57
Empirical Formula: C26H31N7O10

Physical State: Dry powder
Available Amount: 298 mg

Lipinsky:
logP: 2.618
Rotatable bonds: 7
H-donors: 2
H-acceptors: 10
PSA: 200
Number of rings: 4

     

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