TL;DR: 2-Aminobicyclo(3.1.0)hexane-2,6-dicarboxylic acid (CAS 177317-28-1) is a chemical compound with molecular formula C8H11NO4 and molecular weight 185.0688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-aminobicyclo[3.1.0]hexane-2,6-dicarboxylic acid
Also Known As: Eglumetad, 2-aminobicyclo[3.1.0]hexane-2,6-dicarboxylic acid, LY 354740, LY 314582, PDSP1_000258
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H11NO4 |
| Molecular Weight | 185.0688 g/mol |
| XLogP | -3.2 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.0688 Da |
| Heavy Atoms | 13 |
| Complexity | 290.0 |
| SMILES | C1CC(C2C1C2C(=O)O)(C(=O)O)N |
| InChIKey | VTAARTQTOOYTES-UHFFFAOYSA-N |
The XLogP value of -3.2 indicates that 2-Aminobicyclo(3.1.0)hexane-2,6-dicarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Aminobicyclo(3.1.0)hexane-2,6-dicarboxylic acid. Following Lipinski's Rule of Five, 2-Aminobicyclo(3.1.0)hexane-2,6-dicarboxylic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Aminobicyclo(3.1.0)hexane-2,6-dicarboxylic acid is 177317-28-1.
The molecular formula of 2-Aminobicyclo(3.1.0)hexane-2,6-dicarboxylic acid is C8H11NO4.
The molecular weight of 2-Aminobicyclo(3.1.0)hexane-2,6-dicarboxylic acid is 185.0688 g/mol.
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