COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK330879
Chemical Name: (5Z)-2-[(3-bromophenyl)amino]-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-1,3-thiazol-4(5H)-one
Smiles: COc1cc(/C=C/2\SC(=NC2=O)Nc2cccc(c2)Br)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 450.27
Empirical Formula: C17H12BrN3O5S

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 5.188
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 142
Number of rings: 3

     

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