| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2008 | 25 | Yes |
Popular Name: 1-[(2S)-1-ethylpyrrolidin-2-yl]-N-[(2-methoxyphenyl)methyl]-N-(4-pyridylmethyl)methanamine 1-[(2S)-1-ethylpyrrolidin-2-yl]-…
| 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) | 2.66 | 8.2 | -35.41 | 1 | 4 | 1 | 30 | 340.491 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.65 | 5.97 | -4.66 | 0 | 4 | 0 | 29 | 339.483 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 8.35 | -38.33 | 1 | 4 | 1 | 30 | 340.491 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.66 | 8.79 | -98.14 | 2 | 4 | 2 | 31 | 341.499 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.