COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK388965
Chemical Name: bis[2-(3-nitrophenyl)-2-oxoethyl]1,2,2-trimethylcyclopentane-1,3-dicarboxylate
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])COC(=O)C1CCC(C1(C)C)(C)C(=O)OCC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 526.5
Empirical Formula: C26H26N2O10

Physical State: Dry powder
Available Amount: 848 mg

Lipinsky:
logP: 5.001
Rotatable bonds: 10
H-donors: 0
H-acceptors: 10
PSA: 178
Number of rings: 3

     

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