5-Methylindolo[3,2-b]quinoline
PubChem CID: 67598417
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| Compound Synonyms | SCHEMBL8483526 |
|---|---|
| Topological Polar Surface Area | 17.8 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 19.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 316.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 5-methylindolo[3,2-b]quinoline, hydroiodide |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Is Pains | False |
| Molecular Formula | C16H13IN2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | JPONSZNIDBPEJA-UHFFFAOYSA-N |
| Fcsp3 | 0.0625 |
| Rotatable Bond Count | 0.0 |
| Compound Name | 5-Methylindolo[3,2-b]quinoline, hydroiodide |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 360.012 |
| Formal Charge | 0.0 |
| Brenk Violation | True |
| Monoisotopic Mass | 360.012 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 360.19 |
| Covalent Unit Count | 2.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.601832863157894 |
| Inchi | InChI=1S/C16H12N2.HI/c1-18-15-9-5-2-6-11(15)10-14-16(18)12-7-3-4-8-13(12)17-14, /h2-10H,1H3, 1H |
| Smiles | CN1C2=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