COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK794908
Chemical Name: (2Z,5Z)-5-(3-bromo-4-hydroxy-5-nitrobenzylidene)-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one
Smiles: Cc1cc(/N=C/2\S/C(=C\c3cc(Br)c(c(c3)[N+](=O)[O-])O)/C(=O)N2)cc(c1)C

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Molecular Weight: 448.3
Empirical Formula: C18H14BrN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.035
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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