COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148873
Chemical Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-N'-[4-nitro-2-(trifluoromethyl)phenyl]ethane-1,2-diamine
Smiles: [O-][N+](=O)c1cc(ccc1NCCNc1ccc(cc1C(F)(F)F)[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 438.29
Empirical Formula: C16H12F6N4O4

Physical State: Dry powder
Available Amount: 195 mg

Lipinsky:
logP: 6.211
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 115
Number of rings: 2

     

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