COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457509
Chemical Name: 1-[4-chloro-1-(3,4-dichlorobenzyl)-1H-pyrazol-3-yl]-3-(3-nitrophenyl)urea
Smiles: O=C(Nc1nn(cc1Cl)Cc1ccc(c(c1)Cl)Cl)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 440.67
Empirical Formula: C17H12Cl3N5O3

Physical State: Dry powder
Available Amount: 422 mg

Lipinsky:
logP: 5.406
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 104
Number of rings: 3

     

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