COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434864
Chemical Name: N-(4-chloro-3-nitrophenyl)-2-({4-ethyl-5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])Cl)nnc1c1nn(c(c1)C(F)(F)F)C

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Molecular Weight: 489.87
Empirical Formula: C17H15ClF3N7O3S

Physical State: Dry powder
Available Amount: 428 mg

Lipinsky:
logP: 4.753
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 148
Number of rings: 3

     

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