COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK370719
Chemical Name: N-[(1,1-dioxidotetrahydrothiophen-3-yl)methyl]-2,4,6-trinitroaniline
Smiles: [O-][N+](=O)c1cc(cc(c1NCC1CCS(=O)(=O)C1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 360.3
Empirical Formula: C11H12N4O8S

Physical State: Dry powder
Available Amount: 28 mg

Lipinsky:
logP: 1.837
Rotatable bonds: 2
H-donors: 1
H-acceptors: 8
PSA: 192
Number of rings: 2

     

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