COMPOUNDS FOR BIOLOGICAL SCREENING
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Vitas-M Lab ID: STL414573
Chemical Name: 3-(1-ethyl-4-nitro-1H-pyrazol-3-yl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
Smiles: CCn1cc(c(n1)c1nnc2n1CCCCC2)[N+](=O)[O-]

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Molecular Weight: 276.3
Empirical Formula: C12H16N6O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.156
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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