COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK700852
Chemical Name: 4,4'-(4,4-dimethyl-3,5-dinitropiperidine-2,6-diyl)bis(2-methoxyphenol)
Smiles: COc1cc(ccc1O)C1NC(c2ccc(c(c2)OC)O)C(C(C1[N+](=O)[O-])(C)C)[N+](=O)[O-]

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Molecular Weight: 447.44
Empirical Formula: C21H25N3O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.728
Rotatable bonds: 6
H-donors: 3
H-acceptors: 8
PSA: 162
Number of rings: 3

     

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