| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2008 | 29 | Yes |
Popular Name: 2-[[[(3S)-1-cyclopentyl-3-piperidyl]methyl-[2-(1-piperidyl)ethyl]amino]methyl]phenol 2-[[[(3S)-1-cyclopentyl-3-piperi…
None
| 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) | 4.82 | 12.3 | -109.07 | 3 | 4 | 2 | 32 | 401.639 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.82 | 10.11 | -41.65 | 2 | 4 | 1 | 31 | 400.631 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.82 | 12.49 | -55.2 | 2 | 4 | 1 | 35 | 400.631 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.82 | 10.3 | -30.31 | 1 | 4 | 0 | 34 | 399.623 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.82 | 9.91 | -32.64 | 2 | 4 | 1 | 31 | 400.631 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.82 | 12.51 | -86.9 | 3 | 4 | 2 | 32 | 401.639 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.82 | 14.03 | -197.98 | 4 | 4 | 3 | 34 | 402.647 | 8 | ↓ |
