COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL414572
Chemical Name: 3-[3-(4-methyl-3-nitro-1H-pyrazol-1-yl)propyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
Smiles: [O-][N+](=O)c1nn(cc1C)CCCc1nnc2n1CCCCC2

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Molecular Weight: 304.35
Empirical Formula: C14H20N6O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.482
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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