COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL353154
Chemical Name: 4-bromo-3-{(E)-[2-(3-nitrophenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenylacetate
Smiles: CC(=O)Oc1ccc(c(c1)/C=c\1/sc2n(c1=O)nc(n2)c1cccc(c1)[N+](=O)[O-])Br

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Molecular Weight: 487.29
Empirical Formula: C19H11BrN4O5S

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 5.327
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 145
Number of rings: 4

     

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