COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK973125
Chemical Name: 1-(2-hydroxy-2-phenylethyl)-3-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-1-ium
Smiles: Cc1ccc(c(c1)OCc1n[n+](c2n1CCCCC2)CC(c1ccccc1)O)C(C)C

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Saltdata: Br-
Molecular Weight: 420.57
Empirical Formula: C26H34N3O2

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 51
Number of rings: 4

     

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