COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570904
Chemical Name: 3-(2-chlorophenyl)-4-(4-chlorophenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: Clc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccccc1Cl

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Molecular Weight: 457.34
Empirical Formula: C21H14Cl2N4O2S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 7.329
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 4

     

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