COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK303478
Chemical Name: 2-({4-ethyl-5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethanone
Smiles: CCn1c(SCC(=O)N2N=C(CC2(O)C(F)(F)F)C)nnc1c1nn(c(c1)C(F)(F)F)C

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Molecular Weight: 485.41
Empirical Formula: C16H17F6N7O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.129
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 126
Number of rings: 3

     

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