COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK032955
Chemical Name: cyclooctyl4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: O=C1NC(=C(C(N1)c1ccc(c(c1)[N+](=O)[O-])O)C(=O)OC1CCCCCCC1)C

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Molecular Weight: 403.44
Empirical Formula: C20H25N3O6

Physical State: Dry powder
Available Amount: 237 mg

Lipinsky:
logP: 4.459
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 133
Number of rings: 3

     

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