| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 15 | Yes |
Popular Name: [(2R,3S)-1-ethyl-2-(2-pyridyl)pyrrolidin-3-yl]methanamine [(2R,3S)-1-ethyl-2-(2-pyridyl)py…
| 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) | 0.44 | 2.24 | -45.7 | 3 | 3 | 1 | 44 | 206.313 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.44 | 3.16 | -98.29 | 4 | 3 | 2 | 45 | 207.321 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.44 | 4.63 | -102.47 | 4 | 3 | 2 | 45 | 207.321 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
