COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK607630
Chemical Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-5-yl]-5-[(4-nitrobenzyl)oxy]phenol
Smiles: Oc1cc(OCc2ccc(cc2)[N+](=O)[O-])ccc1c1[nH]ncc1c1ccc2c(c1)OCCO2

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Molecular Weight: 445.43
Empirical Formula: C24H19N3O6

Physical State: Dry powder
Available Amount: 392 mg

Lipinsky:
logP: 3.421
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 122
Number of rings: 5

     

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