COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK054970
Chemical Name: 2-[{2-[(2-chloro-4-nitrophenyl)amino]ethyl}(2,4-dinitrophenyl)amino]ethanol
Smiles: OCCN(c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])CCNc1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 425.79
Empirical Formula: C16H16ClN5O7

Physical State: Dry powder
Available Amount: 457 mg

Lipinsky:
logP: 3.799
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 172
Number of rings: 2

     

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