| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 16 | Yes |
Popular Name: N-[[(2S)-1-(2-pyridylmethyl)pyrrolidin-2-yl]methyl]ethanamine N-[[(2S)-1-(2-pyridylmethyl)pyrr…
| 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) | 0.77 | 4.82 | -32.37 | 2 | 3 | 1 | 33 | 220.34 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 5.54 | -88.14 | 3 | 3 | 2 | 34 | 221.348 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.77 | 6.6 | -105.49 | 3 | 3 | 2 | 34 | 221.348 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
