COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL396376
Chemical Name: ethyl1-ethyl-4-({[4-nitro-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-3-yl]carbonyl}amino)-1H-pyrazole-3-carboxylate
Smiles: CCOC(=O)c1nn(cc1NC(=O)c1nn(cc1[N+](=O)[O-])C12CC3CC(C2)CC(C1)C3)CC

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Molecular Weight: 456.5
Empirical Formula: C22H28N6O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.74
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 136
Number of rings: 6

     

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