| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 17 | Yes |
Popular Name: 1-ethyl-N-methyl-N-[(3R,6S)-6-methyl-3-piperidyl]piperidin-4-amine 1-ethyl-N-methyl-N-[(3R,6S)-6-me…
| 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) | 1.64 | 3.61 | -31.58 | 2 | 3 | 1 | 20 | 240.415 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 3.69 | -31.65 | 2 | 3 | 1 | 20 | 240.415 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 4.94 | -81.71 | 3 | 3 | 2 | 24 | 241.423 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 5.86 | -96.05 | 3 | 3 | 2 | 21 | 241.423 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 7.1 | -190.61 | 4 | 3 | 3 | 25 | 242.431 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
