COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566913
Chemical Name: 5-[{3-[(3,3-dimethylpiperidinium-1-yl)methyl]-4-methoxyphenyl}(6-hydroxy-3-methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl)methyl]-3-methyl-6-oxo-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1C[NH+]1CCCC(C1)(C)C)C(c1c(O)[nH]c(=S)n(c1=O)C)c1c(=O)[nH]c(=S)n(c1[O-])C

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Molecular Weight: 559.71
Empirical Formula: C26H33N5O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.432
Rotatable bonds: 7
H-donors: 4
H-acceptors: 5
PSA: 185
Number of rings: 4

     

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