COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016203
Chemical Name: N,N'-dibenzyl-N,N'-bis(2,4-dinitrophenyl)ethane-1,2-diamine
Smiles: [O-][N+](=O)c1cc(ccc1N(Cc1ccccc1)CCN(c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Cc1ccccc1)[N+](=O)[O-]

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Molecular Weight: 572.53
Empirical Formula: C28H24N6O8

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 8.153
Rotatable bonds: 5
H-donors: 0
H-acceptors: 8
PSA: 189
Number of rings: 4

     

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