COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK956442
Chemical Name: methyl4,6-dinitro-3-(1H-pyrrol-1-yl)-1-benzothiophene-2-carboxylate
Smiles: COC(=O)c1sc2c(c1n1cccc1)c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 347.31
Empirical Formula: C14H9N3O6S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 4.542
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 151
Number of rings: 3

     

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