Compound BDG
Identifiers
- Canonical SMILES:
NC[C@H]1O[C@H](O)[C@H](N)[C@@H](O)[C@@H]1O
- IUPAC name:
2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose
- InChi:
InChI=1S/C6H14N2O4/c7-1-2-4(9)5(10)3(8)6(11)12-2/h2-6,9-11H,1,7-8H2/t2-,3-,4-,5-,6+/m1/s1
- InChiKey:
SQTHUUHOUPJYLK-UKFBFLRUSA-N
- SMARTS:
[#7]-[#6]-[#6@H]1-[#8]-[#6@H](-[#8])-[#6@H](-[#7])-[#6@@H](-[#8])-[#6@@H]-1-[#8]
Chemistry rules
| Lipinski's RO5 | Veber | Pfizer's 3/75 |
|---|---|---|
External links
447575
BDG
RNA-SM complexes
Physicochemical filters
| Descriptor | Lipinski's RO5 | Veber | Pfizer's 3/75 | |
|---|---|---|---|---|
| Compliance | ||||
| MW | 178.10 g/mol | |||
| HBA | 6 | |||
| HBD | 5 | |||
| HBA + HBD | ||||
| AlogP | -3.29 | |||
| TPSA | 121.96 | |||
| RB | 1 |