COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL001565
Chemical Name: 5-({3-[(3,3-dimethylpiperidinium-1-yl)methyl]-4-methoxyphenyl}[1-(4-ethoxyphenyl)-6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl]methyl)-3-(4-ethoxyphenyl)-6-oxo-2-thioxo-1,2,3,6-tetrahydro
Smiles: CCOc1ccc(cc1)n1c(=S)[nH]c(=O)c(c1[O-])C(c1c(=O)[nH]c(=S)n(c1O)c1ccc(cc1)OCC)c1ccc(c(c1)C[NH+]1CCCC(C1)(C)C)OC

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Molecular Weight: 771.96
Empirical Formula: C40H45N5O7S2

Available Amount: 0 mg

Lipinsky:
logP: 6.83
Rotatable bonds: 9
H-donors: 4
H-acceptors: 7
PSA: 204
Number of rings: 6

     

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