COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL023230
Chemical Name: N-(2,4-dinitrophenyl)-2,4-dinitroaniline
Smiles: [O-][N+](=O)c1cc(ccc1Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 349.22
Empirical Formula: C12H7N5O8

Physical State: Dry powder
Available Amount: 1452 mg

Lipinsky:
logP: 5.245
Rotatable bonds: 0
H-donors: 1
H-acceptors: 8
PSA: 195
Number of rings: 2

     

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