| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | No |
Popular Name: [4-(4,4-diethyl-1-piperidyl)tetrahydrothiopyran-4-yl]methanamine [4-(4,4-diethyl-1-piperidyl)tetr…
| 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) | 2.36 | 6.84 | -129.27 | 4 | 2 | 2 | 32 | 272.502 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.36 | 5.13 | -45.41 | 3 | 2 | 1 | 31 | 271.494 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 6.48 | -33.5 | 3 | 2 | 1 | 30 | 271.494 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
