COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685887
Chemical Name: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])Nc1nc2c(s1)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 441.22
Empirical Formula: C13H9BrN6O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.946
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 179
Number of rings: 3

     

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