Ligand id: 8806

Name: A1P

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 107.16
Molecular weight 198.11
XLogP -3.15
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Ilies M, Di Costanzo L, North ML, Scott JA, Christianson DW. (2010)
2-aminoimidazole amino acids as inhibitors of the binuclear manganese metalloenzyme human arginase I.
J. Med. Chem., 53 (10): 4266-76. [PMID:20441173]