COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL483659
Chemical Name: 4-[4-amino-5-({2-oxo-2-[(4-phenoxyphenyl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-1-{2-oxo-2-[(4-phenoxyphenyl)amino]ethyl}pyridinium
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nnc(n1N)c1cc[n+](cc1)CC(=O)Nc1ccc(cc1)Oc1ccccc1

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Saltdata: CI-
Molecular Weight: 644.73
Empirical Formula: C35H30N7O4S

Available Amount: 0 mg

Lipinsky:
logP: 2.656
Rotatable bonds: 4
H-donors: 4
H-acceptors: 4
PSA: 162
Number of rings: 6

     

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