COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK800102
Chemical Name: 4-{(Z)-[6-(4-chlorobenzyl)-3,7-dioxo-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-2(3H)-ylidene]methyl}-2-ethoxyphenylacetate
Smiles: CCOc1cc(ccc1OC(=O)C)/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)Cl

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Molecular Weight: 483.93
Empirical Formula: C23H18ClN3O5S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 3.303
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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