COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK232982
Chemical Name: 4-{5-[(2-chloro-6-nitrobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}pyridine
Smiles: Clc1cccc(c1CSc1nnc(n1C)c1ccncc1)[N+](=O)[O-]

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Molecular Weight: 361.81
Empirical Formula: C15H12ClN5O2S

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 3.799
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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