| Synonyms: | |
| Status: | Approved (2011) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| UNII: | 059QF0KO0R |
| Parent Compound: | WATER |
| InChI Key | XLYOFNOQVPJJNP-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | H2O |
| Molecular Weight | 18.02 |
| AlogP | -0.82 |
| Hydrogen Bond Acceptor | 0.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 0.0 |
| Polar Surface Area | 31.5 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 1.0 |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Cardiovascular Diseases | 3 | D002318 | ClinicalTrials |
| Tooth Diseases | 3 | D014076 | ClinicalTrials |
| Periodontitis | 3 | D010518 | ClinicalTrials |
| Tension-Type Headache | 3 | D018781 | ClinicalTrials |
| Dental Caries | 3 | D003731 | ClinicalTrials |
| Pain | 3 | D010146 | ClinicalTrials |
| Hemorrhoids | 3 | D006484 | ClinicalTrials |
| Ileus | 2 | D045823 | ClinicalTrials |
| Tinea Pedis | 2 | D014008 | ClinicalTrials |
| Amyotrophic Lateral Sclerosis | 2 | D000690 | ClinicalTrials |
| Acne Vulgaris | 2 | D000152 | ClinicalTrials |
| Hidradenitis Suppurativa | 2 | D017497 | ClinicalTrials |
| Chemical and Drug Induced Liver Injury | 2 | D056486 | ClinicalTrials |
| Burns | 2 | D002056 | ClinicalTrials |
| Intervertebral Disc Degeneration | 2 | D055959 | ClinicalTrials |
| Severe Acute Respiratory Syndrome | 2 | D045169 | ClinicalTrials |
| Gingivitis | 1 | D005891 | ClinicalTrials |
| Anxiety | 1 | D001007 | ClinicalTrials |
| Alcohol Drinking | 1 | D000428 | ClinicalTrials |
| Celiac Disease | 1 | D002446 | ClinicalTrials |
| Arthritis, Rheumatoid | 1 | D001172 | ClinicalTrials |
| Otitis Media with Effusion | 0 | D010034 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 7732-18-5 |
| ChEBI | 15377 |
| ChEMBL | CHEMBL1098659 |
| DrugBank | DB09145 |
| EPA CompTox | DTXSID6026296 |
| FDA SRS | 059QF0KO0R |
| Human Metabolome Database | HMDB0002111 |
| KEGG | C00001 |
| PDB | O |
| PubChem | 962 |
| SureChEMBL | SCHEMBL624 |