COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK735251
Chemical Name: 3-(3-bromophenyl)-5-[(4-methoxy-3-nitrobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Smiles: COc1ccc(cc1[N+](=O)[O-])CSc1nnc(n1c1ccccc1)c1cccc(c1)Br

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Molecular Weight: 497.37
Empirical Formula: C22H17BrN4O3S

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 7.315
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 111
Number of rings: 4

     

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