COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446839
Chemical Name: 2-[(4-bromobenzyl)sulfanyl]-1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: Brc1ccc(cc1)CSCC(=O)N1N=C(CC1(O)C(F)(F)F)C

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Molecular Weight: 411.24
Empirical Formula: C14H14BrF3N2O2S

Physical State: Dry powder
Available Amount: 1327 mg

Lipinsky:
logP: 2.843
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 78
Number of rings: 2

     

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