N~2~-(4-{[(2-Amino-4-Oxo-1,4,5,6,7,8-Hexahydropyrido[2,3-D]Pyrimidin-6-Yl)Methyl]Amino}Benzoyl)Ornithine
Properties
| Property | Value |
|---|---|
| Formula | C20H27N7O4 |
| IUPAC Name | (2s)-5-amino-2-[[4-[[(6s)-2-amino-4-oxo-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-1-ium-3-id-6-yl]methylamino]benzoyl]amino]pentanoic acid |
| Molecular Mass | 429.473 g·mol−1 |
| Heat of Formation | -516.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.88 ± 1.08 D |
| Volume | 503.44 Å 3 |
| Surface Area | 454.85 Å 2 |
| HOMO Energy | -8.77 ± 0.55 eV |
| LUMO Energy | -0.57 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YYXQTKSKWJEYRP-NHYWBVRUSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |