COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157247
Chemical Name: (2E,5Z)-2-[(3-bromophenyl)imino]-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\S/C(=N/c3cccc(c3)Br)/NC2=O)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 450.27
Empirical Formula: C17H12BrN3O5S

Physical State: Dry powder
Available Amount: 14 mg

Lipinsky:
logP: 3.222
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 142
Number of rings: 3

     

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