| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2011 | 17 | Yes |
Popular Name: [(3S)-3-[(3S)-3-ethoxy-1-piperidyl]-1-methyl-pyrrolidin-3-yl]methanamine [(3S)-3-[(3S)-3-ethoxy-1-piperid…
| 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) | 0.12 | 1.93 | -36.44 | 3 | 4 | 1 | 43 | 242.387 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | 1.56 | -28.69 | 3 | 4 | 1 | 43 | 242.387 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | 0.16 | -43.88 | 3 | 4 | 1 | 43 | 242.387 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | -0.19 | -1.58 | 2 | 4 | 0 | 42 | 241.379 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.12 | 2.65 | -109.8 | 4 | 4 | 2 | 45 | 243.395 | 4 | ↓ |
