COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL304708
Chemical Name: 3-(4-nitrophenyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
Smiles: O=N(=O)c1ccc(cc1)c1nnc2n1CCCCC2

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Molecular Weight: 258.28
Empirical Formula: C13H14N4O2

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 2.797
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 76
Number of rings: 3

     

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