COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK019781
Chemical Name: 2-[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(3-nitrophenyl)ethanone
Smiles: CCc1nnc([nH]1)SCC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 292.32
Empirical Formula: C12H12N4O3S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 1.753
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 129
Number of rings: 2

     

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