COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552292
Chemical Name: 3-[(3-amino-2,4,6-trinitrophenyl)amino]phenol
Smiles: Oc1cccc(c1)Nc1c(cc(c(c1[N+](=O)[O-])N)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 335.23
Empirical Formula: C12H9N5O7

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 5.886
Rotatable bonds: 1
H-donors: 4
H-acceptors: 7
PSA: 195
Number of rings: 2

     

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