COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL353200
Chemical Name: methyl(9E)-9-(2-hydroxybenzylidene)-2,5,7-trinitro-9H-fluorene-4-carboxylate
Smiles: COC(=O)c1cc(cc2c1c1c(cc(cc1/C/2=C/c1ccccc1O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 463.36
Empirical Formula: C22H13N3O9

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 9.157
Rotatable bonds: 4
H-donors: 1
H-acceptors: 9
PSA: 183
Number of rings: 4

     

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