COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK459584
Chemical Name: 1-[4-chloro-1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-3-(4-nitrophenyl)urea
Smiles: O=C(Nc1nn(cc1Cl)Cc1c(F)cccc1Cl)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 424.22
Empirical Formula: C17H12Cl2FN5O3

Physical State: Dry powder
Available Amount: 363 mg

Lipinsky:
logP: 4.617
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 104
Number of rings: 3

     

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