COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565703
Chemical Name: 6-hydroxy-5-{[4-hydroxy-1-(3-methoxyphenyl)-6-oxo-2-sulfanyl-1,6-dihydropyrimidin-5-yl][4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-1-(3-methoxyphenyl)-4-oxo-1,4-dihydropyrimidine-2-thiolate
Smiles: COc1cccc(c1)n1c([S-])nc(=O)c(c1O)C(c1c(O)nc(n(c1=O)c1cccc(c1)OC)S)c1ccc(c(c1)C[NH+]1CCCC1)OC

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Molecular Weight: 701.82
Empirical Formula: C35H35N5O7S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.06
Rotatable bonds: 11
H-donors: 3
H-acceptors: 7
PSA: 176
Number of rings: 6

     

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