COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562887
Chemical Name: 6-hydroxy-5-{[4-hydroxy-1-(2-methylphenyl)-6-oxo-2-sulfanyl-1,6-dihydropyrimidin-5-yl][4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-1-(2-methylphenyl)-4-oxo-1,4-dihydropyrimidine-2-thiolate
Smiles: COc1ccc(cc1C[NH+]1CCCC1)C(c1c(O)nc(n(c1=O)c1ccccc1C)S)c1c(=O)nc(n(c1O)c1ccccc1C)[S-]

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Molecular Weight: 669.83
Empirical Formula: C35H35N5O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.15
Rotatable bonds: 9
H-donors: 3
H-acceptors: 5
PSA: 158
Number of rings: 6

     

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