COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK506771
Chemical Name: (2E,5Z)-2-[(4-bromophenyl)imino]-5-(4-hydroxy-3-nitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: Brc1ccc(cc1)/N=C\1/S/C(=C\c2ccc(c(c2)[N+](=O)[O-])O)/C(=O)N1

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Molecular Weight: 420.24
Empirical Formula: C16H10BrN3O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.278
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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