COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK451540
Chemical Name: N-[1-(2-chloro-6-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2,4-dinitrobenzamide
Smiles: Cc1nn(c(c1NC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C)Cc1c(F)cccc1Cl

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Molecular Weight: 447.81
Empirical Formula: C19H15ClFN5O5

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 3.342
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 138
Number of rings: 3

     

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