| BioID | bio198362 |
|---|
| Name | 2-HEXANOL |
|---|
| ChEMBL ID | CHEMBL45425 |
|---|
| Molecular Formula | C6H14O |
|---|
| Molecular Weight | 102.18 |
|---|
| Molecular Weight (Monoisotopic) | 102.1045 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-Hexanol|Hexan-2-ol |
|---|
| Smiles | CCCCC(C)O |
|---|
| Inchi | InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3 |
|---|
| Inchi Key | QNVRIHYSUZMSGM-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | 1.39 |
|---|
| Records Key | ['31', '2-hexanol', '56'] |
|---|
| Records Name | ['Hexan-2-ol', '2-hexanol', '2-Hexanol'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
