COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611203
Chemical Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-1H-pyrazol-5-yl]-4-ethyl-5-[(4-nitrobenzyl)oxy]phenol
Smiles: CCc1cc(c(cc1OCc1ccc(cc1)[N+](=O)[O-])O)c1[nH]nc(c1c1ccc2c(c1)OCCO2)C

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Molecular Weight: 487.51
Empirical Formula: C27H25N3O6

Physical State: Dry powder
Available Amount: 392 mg

Lipinsky:
logP: 4.873
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 122
Number of rings: 5

     

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