COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457505
Chemical Name: 1-[1-(2-chloro-6-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(3-nitrophenyl)urea
Smiles: O=C(Nc1c(C)nn(c1C)Cc1c(F)cccc1Cl)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 417.83
Empirical Formula: C19H17ClFN5O3

Physical State: Dry powder
Available Amount: 347 mg

Lipinsky:
logP: 4.373
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 104
Number of rings: 3

     

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