COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK460014
Chemical Name: 1-{3-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}-3-(3-nitrophenyl)urea
Smiles: O=C(Nc1cccc(c1)[N+](=O)[O-])NCCCn1nc(c(c1C)Cl)C(F)(F)F

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Molecular Weight: 405.76
Empirical Formula: C15H15ClF3N5O3

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: 4.489
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 104
Number of rings: 2

     

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