| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2004 | 12 | No |
Popular Name: 659 659
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17598-82-2 , 7660-25-5 , 87-79-6 , [16345-64-5] , [87-79-6]
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -2.78 | -10.77 | -8.17 | 5 | 6 | 0 | 110 | 180.156 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 1.121 | Bitter DB |
