COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK069076
Chemical Name: 4-[(E)-{2-[(3-tert-butyl-1H-pyrazol-5-yl)carbonyl]hydrazinylidene}methyl]-2-methoxy-3-nitrophenylacetate
Smiles: COc1c(ccc(c1[N+](=O)[O-])/C=N/NC(=O)c1[nH]nc(c1)C(C)(C)C)OC(=O)C

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Molecular Weight: 403.39
Empirical Formula: C18H21N5O6

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 2.19
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 151
Number of rings: 2

     

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