5-Ethylindolo[3,2-b]quinoline
PubChem CID: 67596684
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | SCHEMBL8478836 |
|---|---|
| Topological Polar Surface Area | 17.8 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 20.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 329.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5-ethylindolo[3,2-b]quinoline, hydroiodide |
| Nih Violation | False |
| Prediction Hob | 0.0 |
| Is Pains | False |
| Molecular Formula | C17H15IN2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | XUVMJOTUTFWBDG-UHFFFAOYSA-N |
| Fcsp3 | 0.1176470588235294 |
| Rotatable Bond Count | 1.0 |
| Compound Name | 5-Ethylindolo[3,2-b]quinoline, hydroiodide |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 374.028 |
| Formal Charge | 0.0 |
| Brenk Violation | True |
| Monoisotopic Mass | 374.028 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 374.22 |
| Covalent Unit Count | 2.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.778694999999999 |
| Inchi | InChI=1S/C17H14N2.HI/c1-2-19-16-10-6-3-7-12(16)11-15-17(19)13-8-4-5-9-14(13)18-15, /h3-11H,2H2,1H3, 1H |
| Smiles | CCN1C2=CC=CC=C2C=C3C1=C4C=CC=CC4=N3.I |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Genipa Americana (Plant) Rel Props:Source_db:cmaup_ingredients