COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085335
Chemical Name: 2,2,2-trichloroethyl4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: O=C1NC(=C(C(N1)c1ccc2c(c1)OCO2)C(=O)OCC(Cl)(Cl)Cl)C

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Molecular Weight: 407.64
Empirical Formula: C15H13Cl3N2O5

Physical State: Dry powder
Available Amount: 636 mg

Lipinsky:
logP: 3.614
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 85
Number of rings: 3

     

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