COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK103360
Chemical Name: 2-{3-[(4-nitrobenzyl)sulfanyl]-5-phenyl-1H-1,2,4-triazol-1-yl}-1,3-benzothiazole
Smiles: [O-][N+](=O)c1ccc(cc1)CSc1nn(c(n1)c1ccccc1)c1nc2c(s1)cccc2

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Molecular Weight: 445.53
Empirical Formula: C22H15N5O2S2

Physical State: Dry powder
Available Amount: 455 mg

Lipinsky:
logP: 7.381
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 142
Number of rings: 5

     

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