4-Hydroxyphenazine-1-carboxylic acid
PubChem CID: 136933101
Connections displayed (default: 10).
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| Compound Synonyms | SCHEMBL16431191 |
|---|---|
| Topological Polar Surface Area | 83.3 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 18.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 336.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 4-hydroxyphenazine-1-carboxylic acid |
| Prediction Hob | 1.0 |
| Xlogp | 1.8 |
| Molecular Formula | C13H8N2O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | FTPQQTMOIZXREL-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -3.092 |
| Rotatable Bond Count | 1.0 |
| Logd | 1.266 |
| Compound Name | 4-Hydroxyphenazine-1-carboxylic acid |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 240.053 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 240.053 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 240.21 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.9729071555555553 |
| Inchi | InChI=1S/C13H8N2O3/c16-10-6-5-7(13(17)18)11-12(10)15-9-4-2-1-3-8(9)14-11/h1-6,16H,(H,17,18) |
| Smiles | C1=CC=C2C(=C1)N=C3C(=CC=C(C3=N2)O)C(=O)O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Aglaia Tomentosa (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Backhousia Citriodora (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Capraria Biflora (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Centipeda Minima (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Mentha Timija (Plant) Rel Props:Source_db:cmaup_ingredients - 6. Outgoing r'ship
FOUND_INto/from Senecio Macrocephalus (Plant) Rel Props:Source_db:cmaup_ingredients - 7. Outgoing r'ship
FOUND_INto/from Upuna Borneensis (Plant) Rel Props:Source_db:cmaup_ingredients