COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL272995
Chemical Name: 2-[(4-bromophenyl)(3,4,5,6-tetrahydro-2H-azepin-7-yl)amino]-1-(4-methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)C(=O)CN(C1=NCCCCC1)c1ccc(cc1)Br

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Saltdata: HBr
Molecular Weight: 415.33
Empirical Formula: C21H23BrN2O2

Available Amount: 0 mg

Lipinsky:
logP: 4.344
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 3

     

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