COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK297207
Chemical Name: N-(3,4-dimethylphenyl)-2-(4-ethyl-5-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamide
Smiles: CCn1c(nnc1SCC(=O)c1cccc(c1)[N+](=O)[O-])CC(=O)Nc1ccc(c(c1)C)C

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Molecular Weight: 453.52
Empirical Formula: C22H23N5O4S

Physical State: Dry powder
Available Amount: 156 mg

Lipinsky:
logP: 4.436
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 148
Number of rings: 3

     

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