COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401795
Chemical Name: [4-(2,6-dichlorobenzyl)piperazin-1-yl]{5-methyl-4-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2-oxazol-3-yl}methanone
Smiles: O=C(c1noc(c1Cn1ncc(c1)[N+](=O)[O-])C)N1CCN(CC1)Cc1c(Cl)cccc1Cl

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Molecular Weight: 479.32
Empirical Formula: C20H20Cl2N6O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.247
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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