COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018174
Chemical Name: 3-(4-tert-butylphenyl)-2,2-dimethylpropyl4-nitrobenzoate
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])OCC(Cc1ccc(cc1)C(C)(C)C)(C)C

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Molecular Weight: 369.46
Empirical Formula: C22H27NO4

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 6.788
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 72
Number of rings: 2

     

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