COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK466804
Chemical Name: 3-(4-ethyl-5-methylthiophen-3-yl)-4-methyl-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4H-1,2,4-triazole
Smiles: CCc1c(C)scc1c1nnc(n1C)SCn1ncc(c1)[N+](=O)[O-]

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Molecular Weight: 364.45
Empirical Formula: C14H16N6O2S2

Physical State: Dry powder
Available Amount: 291 mg

Lipinsky:
logP: 4.358
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 147
Number of rings: 3

     

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