COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL297530
Chemical Name: methyl(9Z)-2,5,7-trinitro-9-(5-phenyl-3H-1,2-dithiol-3-ylidene)-9H-fluorene-4-carboxylate
Smiles: COC(=O)c1cc(cc2c1c1c(cc(cc1/C/2=C/1\SSC(=C1)c1ccccc1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 535.51
Empirical Formula: C24H13N3O8S2

Available Amount: 0 mg

Lipinsky:
logP: 10.04
Rotatable bonds: 2
H-donors: 0
H-acceptors: 8
PSA: 214
Number of rings: 5

     

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