COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431031
Chemical Name: 4-{[(E)-(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(/C=N/c2c(=O)n(n(c2C)C)c2ccccc2)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 382.38
Empirical Formula: C19H18N4O5

Physical State: Dry powder
Available Amount: 203 mg

Lipinsky:
logP: 2.631
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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