COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK534207
Chemical Name: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{3-[5-methyl-2-(propan-2-yl)phenoxy]-5-nitrophenyl}acetamide
Smiles: Cc1ccc(c(c1)Oc1cc(NC(=O)Cn2nc(c(c2C)Br)[N+](=O)[O-])cc(c1)[N+](=O)[O-])C(C)C

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Molecular Weight: 532.35
Empirical Formula: C22H22BrN5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.387
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 147
Number of rings: 3

     

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