COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK743959
Chemical Name: 3-[(3-chlorobenzyl)sulfanyl]-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole
Smiles: Clc1cccc(c1)CSc1nnc(n1c1ccccc1)Cn1c(C)ncc1[N+](=O)[O-]

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Molecular Weight: 440.91
Empirical Formula: C20H17ClN6O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.466
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 119
Number of rings: 4

     

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