| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 16 | Yes |
Popular Name: N-methyl-2-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]ethanamine N-methyl-2-[4-(pyrrolidin-1-ylme…
| 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) | 1.33 | 7.67 | -180.14 | 4 | 3 | 3 | 25 | 228.404 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 4 | -33.34 | 2 | 3 | 1 | 20 | 226.388 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 6.23 | -90.81 | 3 | 3 | 2 | 21 | 227.396 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 5.45 | -80.73 | 3 | 3 | 2 | 24 | 227.396 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
