COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434193
Chemical Name: N-(4-chloro-3-nitrophenyl)-2-[(5-{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])Cl)nnc1c1ccc(cc1)Cn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 571.02
Empirical Formula: C24H23ClN8O5S

Physical State: Dry powder
Available Amount: 863 mg

Lipinsky:
logP: 6.304
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 194
Number of rings: 4

     

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