COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL392668
Chemical Name: N-(2,5-dimethoxyphenyl)-1-ethyl-N-[(1-ethyl-4-nitro-1H-pyrazol-5-yl)carbonyl]-4-nitro-1H-pyrazole-3-carboxamide
Smiles: COc1ccc(c(c1)N(C(=O)c1n(CC)ncc1[N+](=O)[O-])C(=O)c1nn(cc1[N+](=O)[O-])CC)OC

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Molecular Weight: 487.43
Empirical Formula: C20H21N7O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.169
Rotatable bonds: 6
H-donors: 0
H-acceptors: 8
PSA: 183
Number of rings: 3

     

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