COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305168
Chemical Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(2-hydroxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl](1-ethyl-4-nitro-1H-pyrazol-3-yl)methanone
Smiles: CCn1cc(c(n1)C(=O)N1N=C(CC1c1ccccc1O)c1ccc2c(c1)OCCO2)[N+](=O)[O-]

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Molecular Weight: 463.45
Empirical Formula: C23H21N5O6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 0.661
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 135
Number of rings: 5

     

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