COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL001853
Chemical Name: 1-(4-chlorophenyl)-5-{[3-(4-chlorophenyl)-6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl][4-methoxy-3-(piperidinium-1-ylmethyl)phenyl]methyl}-6-oxo-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-ol
Smiles: COc1ccc(cc1C[NH+]1CCCCC1)C(c1c(O)[nH]c(=S)n(c1=O)c1ccc(cc1)Cl)c1c([O-])[nH]c(=S)n(c1=O)c1ccc(cc1)Cl

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Molecular Weight: 724.69
Empirical Formula: C34H31Cl2N5O5S2

Available Amount: 0 mg

Lipinsky:
logP: 6.094
Rotatable bonds: 7
H-donors: 4
H-acceptors: 5
PSA: 185
Number of rings: 6

     

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