COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK769588
Chemical Name: methyl3-hydroxy-4,6-dinitro-1-benzothiophene-2-carboxylate
Smiles: COC(=O)c1sc2c(c1O)c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 298.23
Empirical Formula: C10H6N2O7S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.779
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 166
Number of rings: 2

     

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