COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406895
Chemical Name: (5Z)-5-(3-bromo-4-hydroxy-5-nitrobenzylidene)-2-[(2-chlorophenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C\c1cc(Br)c(c(c1)[N+](=O)[O-])O)Nc1ccccc1Cl

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Molecular Weight: 454.69
Empirical Formula: C16H9BrClN3O4S

Physical State: Dry powder
Available Amount: 153 mg

Lipinsky:
logP: 5.274
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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