COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK466757
Chemical Name: 4-methyl-3-(5-methyl-4-phenylthiophen-3-yl)-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4H-1,2,4-triazole
Smiles: Cn1c(nnc1c1csc(c1c1ccccc1)C)SCn1ncc(c1)[N+](=O)[O-]

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Molecular Weight: 412.5
Empirical Formula: C18H16N6O2S2

Physical State: Dry powder
Available Amount: 322 mg

Lipinsky:
logP: 4.823
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 147
Number of rings: 4

     

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