COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK407001
Chemical Name: 1,3-benzodioxol-5-ylmethyl4-(2-chloro-6-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Smiles: O=C1NC(=C(C(C1)c1c(F)cccc1Cl)C(=O)OCc1ccc2c(c1)OCO2)C

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Molecular Weight: 417.82
Empirical Formula: C21H17ClFNO5

Physical State: Dry powder
Available Amount: 164 mg

Lipinsky:
logP: 3.817
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 73
Number of rings: 4

     

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