COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434910
Chemical Name: 2-({4-ethyl-5-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-methylphenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccccc2C)nnc1CCn1ncc(c1)[N+](=O)[O-]

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Molecular Weight: 415.48
Empirical Formula: C18H21N7O3S

Physical State: Dry powder
Available Amount: 646 mg

Lipinsky:
logP: 3.204
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 148
Number of rings: 3

     

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