COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL006343
Chemical Name: 1-methoxy-2,3,4-trinitrobenzene
Smiles: COc1ccc(c(c1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 243.13
Empirical Formula: C7H5N3O7

Physical State: Dry powder
Available Amount: 3885 mg

Lipinsky:
logP: 1.914
Rotatable bonds: 1
H-donors: 0
H-acceptors: 7
PSA: 146
Number of rings: 1

     

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