COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK097066
Chemical Name: diethyl{2-[(2E)-2-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzylidene}hydrazinyl]-2-oxoethyl}phosphonate
Smiles: CCOP(=O)(CC(=O)N/N=C/c1ccc(c(c1)Cn1nc(c(c1C)[N+](=O)[O-])C)OC)OCC

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Molecular Weight: 481.45
Empirical Formula: C20H28N5O7P

Physical State: Dry powder
Available Amount: 218 mg

Lipinsky:
logP: 3.066
Rotatable bonds: 10
H-donors: 1
H-acceptors: 7
PSA: 159
Number of rings: 2

     

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