COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL265078
Chemical Name: 3-hydroxy-3-(4-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium
Smiles: [O-][N+](=O)c1ccc(cc1)C1(O)C[N+](=C2N1CCCCC2)c1cccc(c1)C(F)(F)F

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Saltdata: Br-
Molecular Weight: 420.41
Empirical Formula: C21H21F3N3O3

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 72
Number of rings: 4

     

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