COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525128
Chemical Name: (3-nitrophenyl)(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)methanone
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])c1ccc2c(c1)OCCOCCOCCOCCO2

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Molecular Weight: 417.42
Empirical Formula: C21H23NO8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.825
Rotatable bonds: 2
H-donors: 0
H-acceptors: 8
PSA: 109
Number of rings: 3

     

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