| Stem definition | Drug id | CAS RN |
|---|---|---|
| 3265 | 59-56-3 |
None
| Property | Value | Reference |
|---|---|---|
| S (Water solubility) | 909 mg/mL | Bocci G, Oprea TI, Benet LZ |
None
None
None
None
None
| Source | Code | Description |
|---|---|---|
| MeSH PA | D005421 | Flavoring Agents |
| MeSH PA | D005503 | Food Additives |
| MeSH PA | D013549 | Sweetening Agents |
| CHEBI has role | CHEBI:78675 | fundamental metabolites |
None
None
None
| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 1.09 | acidic |
| pKa2 | 6.14 | acidic |
| pKa3 | 12.74 | acidic |
None
None
None
| ID | Source |
|---|---|
| 4017760 | VANDF |
| 4019541 | VANDF |
| C0061414 | UMLSCUI |
| CHEBI:29042 | CHEBI |
| CHEBI:4167 | CHEBI |
| BGC | PDB_CHEM_ID |
| 65533 | PUBCHEM_CID |
| DB02843 | DRUGBANK_ID |
| C031590 | MESH_SUPPLEMENTAL_RECORD_UI |
| 4850 | RXNORM |
| 11133 | MMSL |
| 4567 | MMSL |
| 9763 | MMSL |
| d00595 | MMSL |
| 000915 | NDDF |
| 002597 | NDDF |
| 111138002 | SNOMEDCT_US |
| 36816009 | SNOMEDCT_US |
| 67079006 | SNOMEDCT_US |
| C0017725 | UMLSCUI |
| DB09341 | DRUGBANK_ID |
| D005947 | MESH_DESCRIPTOR_UI |
| 5793 | PUBCHEM_CID |
| 2XQS08K9WE | UNII |
| 706O8OR5TM | UNII |
| 845D8509AQ | UNII |
| C324J3XG8S | UNII |
| CIX3U01VAU | UNII |
| H9J4583698 | UNII |
| RW10Q965QO | UNII |
| U4HFF7E3PM | UNII |
None