| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 16 | Yes |
Popular Name: 2-[(2S)-2-(2-ethyl-5-methyl-pyrazol-3-yl)pyrrolidin-1-yl]ethanamine 2-[(2S)-2-(2-ethyl-5-methyl-pyra…
| 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) | 0.42 | 2.75 | -49.67 | 3 | 4 | 1 | 49 | 223.344 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | 4.08 | -36.77 | 3 | 4 | 1 | 48 | 223.344 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.42 | 4.48 | -123.54 | 4 | 4 | 2 | 50 | 224.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
