COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL426437
Chemical Name: N-{[4-ethyl-5-({2-[(2-methoxy-5-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-3-nitrobenzamide
Smiles: CCn1c(CNC(=O)c2cccc(c2)[N+](=O)[O-])nnc1SCC(=O)Nc1cc(C)ccc1OC

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Molecular Weight: 484.54
Empirical Formula: C22H24N6O5S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 3.264
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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