COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK387442
Chemical Name: 2,4,5,7-tetranitro-9-[4-(octyloxy)benzylidene]-9H-fluorene
Smiles: CCCCCCCCOc1ccc(cc1)/C=C/1\c2cc(cc(c2c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 562.54
Empirical Formula: C28H26N4O9

Physical State: Dry powder
Available Amount: 3774 mg

Lipinsky:
logP: 12.24
Rotatable bonds: 7
H-donors: 0
H-acceptors: 9
PSA: 192
Number of rings: 4

     

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