COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK135937
Chemical Name: 2-{[4-ethyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
Smiles: CCn1c(SCC(=O)c2ccc(cc2)F)nnc1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 386.41
Empirical Formula: C18H15FN4O3S

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 4.84
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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