COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL229234
Chemical Name: 1-(4-fluorophenyl)-2-{3,4,5,6-tetrahydro-2H-azepin-7-yl[3-(trifluoromethyl)phenyl]amino}ethanone
Smiles: Fc1ccc(cc1)C(=O)CN(c1cccc(c1)C(F)(F)F)C1=NCCCCC1

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Saltdata: HBr
Molecular Weight: 392.4
Empirical Formula: C21H20F4N2O

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 4.454
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 32
Number of rings: 3

     

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