COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK111003
Chemical Name: 1-(2-methoxy-5-{(E)-[2-(4-nitrophenyl)hydrazinylidene]methyl}benzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)/C=N/Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 424.42
Empirical Formula: C20H20N6O5

Physical State: Dry powder
Available Amount: 341 mg

Lipinsky:
logP: 5.576
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 143
Number of rings: 3

     

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