COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK957000
Chemical Name: 5-methyl-2-(4-nitrophenyl)-4-[(E)-{[3-(trifluoromethyl)benzyl]imino}methyl]-1,2-dihydro-3H-pyrazol-3-one
Smiles: [O-][N+](=O)c1ccc(cc1)n1[nH]c(c(c1=O)/C=N/Cc1cccc(c1)C(F)(F)F)C

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Molecular Weight: 404.35
Empirical Formula: C19H15F3N4O3

Physical State: Dry powder
Available Amount: 35 mg

Lipinsky:
logP: 4.119
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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