COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052275
Chemical Name: 1,3-benzodioxol-5-ylmethyl4-(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)OCc1ccc2c(c1)OCO2)C

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Molecular Weight: 427.37
Empirical Formula: C20H17N3O8

Physical State: Dry powder
Available Amount: 547 mg

Lipinsky:
logP: 2.609
Rotatable bonds: 6
H-donors: 3
H-acceptors: 8
PSA: 151
Number of rings: 4

     

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