COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150189
Chemical Name: 5-({3-[1-(3,3-dimethylpiperidinium-1-yl)ethyl]-4-methoxyphenyl}[6-hydroxy-1-(3-methoxyphenyl)-4-oxo-2-sulfanyl-1,4-dihydropyrimidin-5-yl]methyl)-3-(3-methoxyphenyl)-6-oxo-2-sulfanyl-3,6-dihydropyrimid
Smiles: COc1cccc(c1)n1c(S)nc(=O)c(c1[O-])C(c1c(=O)nc(n(c1O)c1cccc(c1)OC)S)c1ccc(c(c1)C([NH+]1CCCC(C1)(C)C)C)OC

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Molecular Weight: 757.93
Empirical Formula: C39H43N5O7S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.005
Rotatable bonds: 11
H-donors: 2
H-acceptors: 7
PSA: 218
Number of rings: 6

     

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