COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505573
Chemical Name: 2-[(E)-{2-[4,6-di(azepan-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-4-nitrophenol
Smiles: Oc1ccc(cc1/C=N/Nc1nc(nc(n1)N1CCCCCC1)N1CCCCCC1)[N+](=O)[O-]

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Molecular Weight: 454.53
Empirical Formula: C22H30N8O3

Physical State: Dry powder
Available Amount: 18 mg

Lipinsky:
logP: 3.354
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 135
Number of rings: 4

     

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