COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK700996
Chemical Name: N-(2,4-dinitrophenyl)-N'-(2,4,6-trinitrophenyl)benzene-1,3-diamine
Smiles: [O-][N+](=O)c1cc(ccc1Nc1cccc(c1)Nc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 485.33
Empirical Formula: C18H11N7O10

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 6.852
Rotatable bonds: 0
H-donors: 2
H-acceptors: 10
PSA: 253
Number of rings: 3

     

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