| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 26th, 2010 | 15 | Yes |
Popular Name: (1S)-1-(3-pyridyl)-2-tetrahydropyran-4-yl-ethanamine (1S)-1-(3-pyridyl)-2-tetrahydrop…
| 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) | -0.60 | 3.05 | -51.36 | 3 | 3 | 1 | 50 | 207.297 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.60 | 2.72 | -5.53 | 2 | 3 | 0 | 48 | 206.289 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0804195A2; US5559124 | IBM Patent Data |
