COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL574847
Chemical Name: (2E,5E)-2-[(2E)-(3-bromo-4-methoxybenzylidene)hydrazinylidene]-5-(2,4-dichloro-5-nitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1Br)/C=N/N=C/1\NC(=O)/C(=C\c2cc([N+](=O)[O-])c(cc2Cl)Cl)/S1

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Molecular Weight: 530.19
Empirical Formula: C18H11BrCl2N4O4S

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 6.579
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 134
Number of rings: 3

     

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