COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK039231
Chemical Name: 4-bromo-5-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}-2-phenylpyridazin-3(2H)-one
Smiles: [O-][N+](=O)c1cc(ccc1N1CCN(CC1)c1cnn(c(=O)c1Br)c1ccccc1)C(F)(F)F

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Molecular Weight: 524.3
Empirical Formula: C21H17BrF3N5O3

Physical State: Dry powder
Available Amount: 437 mg

Lipinsky:
logP: 5.519
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 84
Number of rings: 4

     

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