COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003143
Chemical Name: 5-[(6-hydroxy-4-oxo-3-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(4-methoxy-3-{[2-(pyridin-3-yl)piperidinium-1-yl]methyl}phenyl)methyl]-6-oxo-1-phenyl-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-olat
Smiles: COc1ccc(cc1C[NH+]1CCCCC1c1cccnc1)C(c1c(O)[nH]c(=S)n(c1=O)c1ccccc1)c1c([O-])[nH]c(=S)n(c1=O)c1ccccc1

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Molecular Weight: 732.88
Empirical Formula: C39H36N6O5S2

Available Amount: 0 mg

Lipinsky:
logP: 4.844
Rotatable bonds: 8
H-donors: 4
H-acceptors: 5
PSA: 198
Number of rings: 7

     

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