COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079258
Chemical Name: (2Z,5Z)-5-{3-bromo-4-[(4-nitrobenzyl)oxy]benzylidene}-3-ethyl-2-(ethylimino)-1,3-thiazolidin-4-one
Smiles: CC/N=C/1\S/C(=C\c2ccc(c(c2)Br)OCc2ccc(cc2)[N+](=O)[O-])/C(=O)N1CC

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Molecular Weight: 490.38
Empirical Formula: C21H20BrN3O4S

Physical State: Dry powder
Available Amount: 146 mg

Lipinsky:
logP: 4.386
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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